(R)-(-)-4-Benzyl-3-propionyl-2-oxazolidinone

C₁₃H₁₅NO₃CAS 131685-53-5233.27 g/mol

Open in Covalent MOL file

Amide Carbamate

Properties

Molecular formula: C₁₃H₁₅NO₃
Molar mass: 233.27 g/mol
Exact mass: 233.1052 Da
logP: 1.99Crippen estimate
Polar surface area: 46.6 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 3
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

131685-53-5

SMILES

CCC(=O)N1[C@@H](COC1=O)CC2=CC=CC=C2

InChIKey

WHOBYFHKONUTMW-LLVKDONJSA-N

InChI

InChI=1S/C13H15NO3/c1-2-12(15)14-11(9-17-13(14)16)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3/t11-/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with (R)-(-)-4-Benzyl-3-propionyl-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

(S)-(+)-3-Acetyl-4-benzyl-2-oxazolidinone132836-66-967 % similar (4S)-3-(1-Oxopropyl)-4-phenyl-2-oxazolidinone184363-66-464 % similar 1-(4-Benzoyl-1-piperazinyl)-1-propanone314728-85-343 % similar 2-Phenethyl propionate122-70-342 % similar 1,3-Diethyl 2-(phenylmethyl)propanedioate607-81-840 % similar Benzyl propionate122-63-440 % similar 1-(Phenylmethyl) (2S)-5-oxo-1,2-pyrrolidinedicarboxylate32159-21-040 % similar Phenylmethyl (4S)-4-(1-methylethyl)-2,5-dioxo-3-oxazolidinecarboxylate158257-41-139 % similar

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

Same formula

(4S)-(+)-4-Benzyl-3-propionyl-2-oxazolidinone101711-78-8 Mecarbinate15574-49-9 Benzyl 4-oxo-1-piperidinecarboxylate19099-93-5 Methyl 1-benzyl-5-oxo-3-pyrrolidinecarboxylate51535-00-3 1-Benzoyl-4-piperidinecarboxylic acid5274-99-7 Benzyl 3-oxopiperidine-1-carboxylate61995-20-8 5-Methoxy-2-methylindole-3-acetic acid methyl ester7588-36-5

Elsewhere

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