(S)-4-Benzyloxazolidine-2-thione

C₁₀H₁₁NOSCAS 145588-94-9193.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₁NOS
Molar mass: 193.26 g/mol
Exact mass: 193.0561 Da
logP: 1.50Crippen estimate
Polar surface area: 21.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

145588-94-9

SMILES

C1[C@@H](NC(=S)O1)CC2=CC=CC=C2

InChIKey

WJSUXYCBZFLXIK-VIFPVBQESA-N

InChI

InChI=1S/C10H11NOS/c13-10-11-9(7-12-10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,13)/t9-/m0/s1

Weigh it out

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Names and synonyms

1 names

(S)-4-Benzyl-1,3-oxazolidine-2-thione

Work with (S)-4-Benzyloxazolidine-2-thione

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

(S)-4-Phenyl-1,3-oxazolidine-2-thione190970-57-157 % similar (S)-4-Benzylthiazolidine-2-thione171877-39-747 % similar 4-(4-Hydrazinobenzyl)-2-oxazolidinone171550-12-243 % similar (2S)-2-Benzylaziridine73058-30-742 % similar Cbz-D-phenylalaninol58917-85-441 % similar (S)-Cbz-phenylalaninol6372-14-141 % similar Phenylacetaldehyde dimethyl acetal101-48-440 % similar (R)-4-Benzyl-2-oxazolidinone102029-44-739 % similar

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

Elsewhere

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