(4S,5R)-(-)-4-Methyl-5-phenyl-2-oxazolidinone

C₁₀H₁₁NO₂CAS 16251-45-9177.20 g/mol

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Properties

Molecular formula: C₁₀H₁₁NO₂
Molar mass: 177.20 g/mol
Exact mass: 177.0790 Da
logP: 1.86Crippen estimate
Polar surface area: 38.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1
Stereocentres: S, Rin SMILES atom order

Identifiers

CAS number

16251-45-9

SMILES

C[C@H]1[C@H](OC(=O)N1)C2=CC=CC=C2

InChIKey

PPIBJOQGAJBQDF-CBAPKCEASA-N

InChI

InChI=1S/C10H11NO2/c1-7-9(13-10(12)11-7)8-5-3-2-4-6-8/h2-7,9H,1H3,(H,11,12)/t7-,9-/m0/s1

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Names and synonyms

1 names

4-Methyl-5-phenyl-2-oxazolidinone, (4S,5R)-

Work with (4S,5R)-(-)-4-Methyl-5-phenyl-2-oxazolidinone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Phenylethyl acetate93-92-541 % similar Phenylmethanediol diacetate581-55-539 % similar Isopropyl benzoate939-48-039 % similar Boc-L-phenylglycinol117049-14-638 % similar 1-Phenylethyl propionate120-45-638 % similar trans-Stilbene oxide1439-07-238 % similar Chalcone epoxide5411-12-138 % similar Methyl α-phenylbenzeneacetate3469-00-936 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Acetoacetanilide102-01-2 (R)-4-Benzyl-2-oxazolidinone102029-44-7 (3R)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid103733-65-9 3,5-Dimethoxyphenylacetonitrile13388-75-5 1,3-Dihydro-4-(2-hydroxyethyl)-2H-indol-2-one139122-19-3 5,6-Dimethoxyindole14430-23-0 2,5-Dimethoxyphenylacetonitrile18086-24-3 N-(4-Acetylphenyl)acetamide2719-21-3

Elsewhere

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