Category: oxazolidine

Fullam, Elizabeth published the artcilePhysicochemical properties and Mycobacterium tuberculosis transporters: keys to efficacious antitubercular drugs?, Product Details of C14H17FN4O3, the publication is RSC Medicinal Chemistry (2021), 12(1), 43-56, database is CAplus and MEDLINE.

A review. Securing novel, safe, and effective medicines to treat Mycobacterium tuberculosis remains an elusive goal, particularly influenced by the largely impervious Mtb envelope that limits exposure and thus efficacy of inhibitors at their cellular and periplasmic targets. The impact of physicochem. properties on pharmacokinetic parameters that govern oral absorption and exposure at sites of infection is considered alongside how these properties influence penetration of the Mtb envelope, with the likely influence of transporter proteins. The findings are discussed to benchmark current drugs and the emerging pipeline, while considering tactics for future rational and targeted design strategies, based around emerging data on Mtb transporters and their structures and functions.

RSC Medicinal Chemistry published new progress about 1219707-39-7. 1219707-39-7 belongs to oxazolidine, auxiliary class Other Aliphatic Heterocyclic,Oxazolidine,Chiral,Fluoride,Benzene,Amide,Alcohol,Anti-infection, name is (R)-3-(3-Fluoro-4-(1-methyl-5,6-dihydro-1,2,4-triazin-4(1H)-yl)phenyl)-5-(hydroxymethyl)oxazolidin-2-one, and the molecular formula is C14H17FN4O3, Product Details of C14H17FN4O3.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Yang, Ke published the artcileNickel-catalyzed decarboxylative acylation of heteroarenes by sp² C-H functionalization, Category: oxazolidine, the publication is Chemistry – A European Journal (2014), 20(24), 7241-7244, database is CAplus and MEDLINE.

Nickel-catalyzed ligand-free decarboxylative cross-coupling of azole derivatives with α-oxoglyoxylic acids was developed. This work represents the first example of decarboxylative cross-coupling reactions, in a C-H bond functionalization manner, through nickel catalysis, and tolerates various functional groups. Addnl., this approach provides an efficient access to (ox)azole ketones, an important structural motif in many medicinal compounds with a broad range of biol. activities. © 2014 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Chemistry – A European Journal published new progress about 72571-06-3. 72571-06-3 belongs to oxazolidine, auxiliary class Oxazole,Bromide,Benzene, name is 5-(4-Bromophenyl)oxazole, and the molecular formula is C8H7NO4, Category: oxazolidine.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Chen, Peng published the artcileDiscovery of novel, potent, isosteviol-based antithrombotic agents, Recommanded Product: 5-(4-Bromophenyl)oxazole, the publication is European Journal of Medicinal Chemistry (2019), 111722, database is CAplus and MEDLINE.

Thrombosis is a pathol. coagulation process and can lead to many serious thrombotic diseases. Here, we report a novel potent antithrombotic compound (6k) based on isosteviol with anticoagulant and antiplatelet activities. 6k selectively inhibited FXa (K_i = 0.015μM) against a panel of serine proteases and showed excellent anticoagulant activity (significant prolongation of ex vivo PT and aPTT over the vehicle, p < 0.01). 6k also significantly inhibited ADP-induced platelet aggregation in rats relative to the vehicle (p < 0.01). Furthermore, 6k exhibited potent ex vivo and in vivo antithrombotic activity in rats relative to the vehicle (p < 0.01 and p < 0.0001, resp.). Novel structure 6k, with potent antithrombotic activity, is expected to lead a promising approach for the development of antithrombotic agents.

European Journal of Medicinal Chemistry published new progress about 72571-06-3. 72571-06-3 belongs to oxazolidine, auxiliary class Oxazole,Bromide,Benzene, name is 5-(4-Bromophenyl)oxazole, and the molecular formula is C9H6BrNO, Recommanded Product: 5-(4-Bromophenyl)oxazole.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Li, Bijin published the artcileDual-emissive 2-(2′-hydroxyphenyl)oxazoles for high performance organic electroluminescent devices: discovery of a new equilibrium of excited state intramolecular proton transfer with a reverse intersystem crossing process, Safety of 5-(4-Bromophenyl)oxazole, the publication is Chemical Science (2018), 9(5), 1213-1220, database is CAplus and MEDLINE.

The photoluminescence (PL) and electroluminescence (EL) properties of two highly efficient excited state intramol. proton transfer (ESIPT) mols., 2-(2′-hydroxyphenyl)oxazoles containing one triphenylamine (TPA) (1) and two TPAs (2) resp., are studied systematically. The enol-forms of both 1 and 2 possess highly hybridized local and charge transfer (HLCT) excited state character, while their excited-state keto-forms are not of obvious HLCT character. A 1-based device exhibits green-white electroluminescence with Commission Internationale de l’Eclairage (CIE) coordinates of (0.25, 0.41) and a high external quantum efficiency (EQE) up to 5.3%, which is the highest EQE value recorded for single mol. white light-emitting materials. A 2-based device shows sky-blue emission with CIE coordinates of (0.18, 0.16) and an EQE of 8.0%, which is the highest EQE in the reported HLCT materials. The fluorescence intensities of the enol-forms of 1 and 2 in EL spectra are increased remarkably relative to their PL spectra. Exptl. data and theor. calculations reveal a new ESIPT equilibrium with a reverse intersystem crossing (RISC) process arising from the HLCT character. In EL, the RISC of the enol-form excitons from the triplet state to the singlet state triggers an increase in the number of enol-form singlet excitons, which further leads to a shift of the ESIPT equilibrium towards an enhanced enol-form emission. Thus, the difference between the ESIPT equilibrium in PL and EL may be ascribed to the HLCT character of the enol-form excited state.

Chemical Science published new progress about 72571-06-3. 72571-06-3 belongs to oxazolidine, auxiliary class Oxazole,Bromide,Benzene, name is 5-(4-Bromophenyl)oxazole, and the molecular formula is C9H6BrNO, Safety of 5-(4-Bromophenyl)oxazole.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Yeo, Helen C. H. published the artcileMicrowave-induced volatiles of the Maillard model system under different pH conditions, Related Products of oxazolidine, the publication is Journal of Agricultural and Food Chemistry (1991), 39(2), 370-3, database is CAplus.

The volatile heterocyclic compounds produced from a D-glucose/L-cysteine browning model system by microwave irradiation were isolated and identified by gas chromatog. and mass spectrometry. Microwave samples were prepared at different pH values. As the pH increased, the total volatiles generated also increased. Twenty-two compounds were identified. The major compounds formed at pH 2, 5, and 7 were furans, pyrroles, and thiophenes. At pH 9, the major compounds formed were oxazoles, pyrazines, thiazoles, pyranones, and furanones. The samples at pH 2, 5, and 7 had a pungent and sulfurous odor, and those at pH 9 had a nutty, meaty, and roasted aroma. 2-Methylthiazolidine was detected for the first time in a sugar/amino acid model system; the mechanism for its formation is proposed to be formation of a hemimercaptal intermediate at different pH values.

Journal of Agricultural and Food Chemistry published new progress about 20662-83-3. 20662-83-3 belongs to oxazolidine, auxiliary class Oxazole, name is 4,5-Dimethyloxazole, and the molecular formula is C15H21BO3, Related Products of oxazolidine.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Shimoda, Mitsuya published the artcileIdentification and Sensory Characterization of Volatile Flavor Compounds in Sesame Seed Oil, SDS of cas: 20662-83-3, the publication is Journal of Agricultural and Food Chemistry (1996), 44(12), 3909-3912, database is CAplus.

Volatile flavor compounds in sesame seed oil were investigated. Com. processed sesame seed oil was steam distilled under reduced pressure, and volatiles from the distillate were separated by an adsorptive column method. Among 171 individual peaks detected, 134 peaks were definitely or tentatively identified by anal. of mass spectra and modified Kovats indexes. To elucidate the compounds directly contributing to the characteristic flavor, the odor concentrate was fractionated by silica gel thin-layer chromatog. and preparative gas chromatog. As a result, 1-(5-methyl-2-furanyl)-1-propanone, 3-formylthiophene, 2-propyl-4-methylthiazole, 2-ethyl-4-methyl-1H-pyrrole, 2-ethyl-6-methylpyrazine, 2-ethyl-5-methylpyrazine, 4,5-dimethylisothiazole, 4,5-dimethylthiazole, 2,6-diethylpyrazine, 2-ethyl-2,5-dimethylpyrazine, 1-(2-pyridinyl)ethanone, and 1-(1-methyl-1H-pyrrol-2-yl)ethanone were considered to be principal contributors of sesame seed oil flavor.

Journal of Agricultural and Food Chemistry published new progress about 20662-83-3. 20662-83-3 belongs to oxazolidine, auxiliary class Oxazole, name is 4,5-Dimethyloxazole, and the molecular formula is C24H29N5O3, SDS of cas: 20662-83-3.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Chen, Yue-Gang published the artcileNickel-catalyzed Enantioselective Hydroarylation and Hydroalkenylation of Styrenes, Safety of (4S,4’S)-2,2′-(Cyclohexane-1,1-diyl)bis(4-phenyl-4,5-dihydrooxazole), the publication is Journal of the American Chemical Society (2019), 141(8), 3395-3399, database is CAplus and MEDLINE.

We have developed a Ni-catalyzed enantioselective hydroarylation of styrenes with arylboronic acids using MeOH as the hydrogen source, providing an efficient method to access 1,1-diarylalkanes, which are essential structural units in many biol. active compounds In addition, Ni-catalyzed enantioselective hydrovinylation of styrenes with vinylboronic acids is also realized with good yields and enantioselectivities. The synthetic utility was demonstrated by the efficient synthesis of (R)-(-)-ibuprofen.

Journal of the American Chemical Society published new progress about 2185014-88-2. 2185014-88-2 belongs to oxazolidine, auxiliary class BOX Ligands, name is (4S,4’S)-2,2′-(Cyclohexane-1,1-diyl)bis(4-phenyl-4,5-dihydrooxazole), and the molecular formula is C24H26N2O2, Safety of (4S,4’S)-2,2′-(Cyclohexane-1,1-diyl)bis(4-phenyl-4,5-dihydrooxazole).

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Whelligan, Daniel K. published the artcileAminopyrazine Inhibitors Binding to an Unusual Inactive Conformation of the Mitotic Kinase Nek2: SAR and Structural Characterization, Formula: C5H7NO, the publication is Journal of Medicinal Chemistry (2010), 53(21), 7682-7698, database is CAplus and MEDLINE.

We report herein the first systematic exploration of inhibitors of the mitotic kinase Nek2. Starting from HTS hit aminopyrazine I, compounds with improved activity were identified using structure-based design. Our structural biol. investigations reveal two notable observations. First, I and related compounds bind to an unusual, inactive conformation of the kinase which to the best of our knowledge has not been reported for other types of kinase inhibitors. Second, a phenylalanine residue at the center of the ATP pocket strongly affects the ability of the inhibitor to bind to the protein. The implications of these observations are discussed, and the work described here defines key features for potent and selective Nek2 inhibition, which will aid the identification of more advanced inhibitors of Nek2.

Journal of Medicinal Chemistry published new progress about 20662-83-3. 20662-83-3 belongs to oxazolidine, auxiliary class Oxazole, name is 4,5-Dimethyloxazole, and the molecular formula is C9H21NO3, Formula: C5H7NO.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Shin, Bo Ram published the artcileComparison of the contents of benzo(a)pyrene, sesamol and sesamolin, and volatiles in sesame oils according to origins of sesame seeds, COA of Formula: C5H7NO, the publication is Applied Biological Chemistry (2016), 59(1), 129-141, database is CAplus.

The objective of the present study was to compare the contents of antioxidants (sesamol and sesamolin) and benzo(a)pyrene (BaP), as well as the volatile profiles in sesame oil obtained from sesame seeds cultivated in four different areas in Korea, and those cultivated in other countries, including Ethiopia, India, and China. The sesamol content was lower in Korean sesame oils than in Ethiopian, Indian, and Chinese sesame oils, whereas sesamolin content was higher in sesame oils derived from Korea than those in sesame oils derived from other countries. There was also a difference in the contents of BaP in the sesame oils obtained from seeds in different cultivated areas. The volatiles that allowed Korean samples to be discriminated from those of other countries were mainly pyrroles and sulfur-containing compounds such as 1-ethyl-1H-pyrrole, 2-ethyl-4-methyl-1H-pyrrole, 2,4-dimethylthiazole, and 5-ethyl-4-methylthiazole.

Applied Biological Chemistry published new progress about 20662-83-3. 20662-83-3 belongs to oxazolidine, auxiliary class Oxazole, name is 4,5-Dimethyloxazole, and the molecular formula is C11H20N2O3, COA of Formula: C5H7NO.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem

Fan, Chunying published the artcileChemical compositions and copper(II) adsorption properties of sequentially extracted humic substances, including different humin fractions, Related Products of oxazolidine, the publication is Fresenius Environmental Bulletin (2018), 27(10), 6485-6499, database is CAplus.

Humin (HU) is the least understood humic substance (HS) fractions due to its close associations with soil mineral colloids. Here, humic acid (HA), fulvic acid (FA), HU, iron-bound HU (HUi), claybound HU (HUc) and residual HU (HUr) were sequentially extracted from an Alfisol of northeast China. Elemental anal., solid-state carbon-13 cross-polarization magic-angle-spinning NMR (13C CPMAS NMR) spectroscopy and pyrolysis-gas chromatog./mass spectrometry (Py-GC/MS) were used to characterize HS fractions. The adsorption isotherms of Cu(II) on HS fractions were obtained using batch equilibrium method. Among these HS fractions, HA contained higher proportion of phenols, whereas HUc exhibited higher proportion of aliphatic hydrocarbons. For the different HU fractions, n-alkanes/n-alkenes were particularly abundant in HUc, whereas polysaccharides were abundant in HUr. The adsorption of Cu(II) on HS fractions well fitted both Freundlich and Langmuir equations. The maximum amounts of Cu(II) adsorbed was FA > HUi > HA > HUc > HU > HUr, which was pos. correlated with their O/C ratio and carbonyl C whereas neg. correlated with C/N ratio (p < 0.01). The results suggested that HU is highly heterogeneous in terms of their chem. compositions and plays important role in controlling the behavior and fate of Cu(II) in the environment.

Fresenius Environmental Bulletin published new progress about 20662-83-3. 20662-83-3 belongs to oxazolidine, auxiliary class Oxazole, name is 4,5-Dimethyloxazole, and the molecular formula is C5H7NO, Related Products of oxazolidine.

Referemce:
https://en.wikipedia.org/wiki/Oxazolidine,
Oxazolidine | C3H7NO – PubChem