(2S,3R)-3-(N-Benzyloxycarbonyl)amino-1-chloro-4-phenylthiobutan-2-ol
Properties
- Molecular formula
- C18H20ClNO3S
- Molar mass
- 365.87 g/mol
- Exact mass
- 365.0852 Da
- logP
- 3.88Crippen estimate
- Polar surface area
- 62.0 Ų
- H-bond donors / acceptors
- 2 / 4
- Rotatable bonds
- 8
Identifiers
CAS number
159878-02-1SMILES
OC(=N[C@@H](CSc1ccccc1)[C@H](O)CCl)OCc1ccccc1InChIKey
YMCLVAZUQJPLTE-DLBZAZTESA-NInChI
InChI=1S/C18H20ClNO3S/c19-11-17(21)16(13-24-15-9-5-2-6-10-15)20-18(22)23-12-14-7-3-1-4-8-14/h1-10,16-17,21H,11-13H2,(H,20,22)/t16-,17+/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Carbamic acid, N-[(1R,2S)-3-chloro-2-hydroxy-1-[(phenylthio)methyl]propyl]-, phenylmethyl ester
- Carbamic acid, [3-chloro-2-hydroxy-1-[(phenylthio)methyl]propyl]-, phenylmethyl ester, [S-(R*,S*)]-
- Carbamic acid, [(1R,2S)-3-chloro-2-hydroxy-1-[(phenylthio)methyl]propyl]-, phenylmethyl ester
- (2S,3R)-1-Chloro-2-hydroxy-3-[(benzyloxycarbonyl)amino]-4-(phenylthio)butane
- (2S,3R)-(-)-3-(Benzyloxycarbonylamino)-1-chloro-4-phenylthiobutan-2-ol