Benzyl (2R,3S)-(-)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate

C₂₄H₂₁NO₄CAS 100516-54-9387.44 g/mol

Open in Covalent MOL file

Carbamate Ester Lactone

Properties

Molecular formula: C₂₄H₂₁NO₄
Molar mass: 387.44 g/mol
Exact mass: 387.1471 Da
logP: 4.66Crippen estimate
Polar surface area: 55.8 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 4
Stereocentres: R, Sin SMILES atom order

Identifiers

CAS number

100516-54-9

SMILES

C1C(=O)O[C@@H]([C@@H](N1C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChIKey

HECRUWTZAMPQOS-XZOQPEGZSA-N

InChI

InChI=1S/C24H21NO4/c26-21-16-25(24(27)28-17-18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)23(29-21)20-14-8-3-9-15-20/h1-15,22-23H,16-17H2/t22-,23+/m0/s1

Weigh it out

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

Names and synonyms

1 names

(2R,3S)-(-)-N-Z-6-Oxo-2,3-diphenylmorpholine

Work with Benzyl (2R,3S)-(-)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate

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

tert-Butyl (2R,3S)-6-oxo-2,3-diphenylmorpholine-4-carboxylate112741-49-865 % similar 1,1-Dimethylethyl (2S,3R)-6-oxo-2,3-diphenyl-4-morpholinecarboxylate112741-50-165 % similar (2S)-1-(Benzyloxycarbonyl)azetidine-2-carboxylic acid25654-52-845 % similar 1-(Phenylmethyl) (2S,4R)-4-hydroxy-1,2-pyrrolidinedicarboxylate13504-85-345 % similar (S)-2-(Aminomethyl)-1-cbz-pyrrolidine119020-03-044 % similar Phenylmethyl 3-amino-1-azetidinecarboxylate112257-20-244 % similar Benzyl 3-hydroxyazetidine-1-carboxylate128117-22-644 % similar Benzyl 3-oxopyrrolidine-1-carboxylate130312-02-644 % similar

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

Same formula

Fmoc-L-phenylalanine35661-40-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook