Name: Name:Carbamic acid, N-[(1R)-3-chloro-2-oxo-1-[(phenylthio)methyl]propyl]-, phenylmethyl ester
Brand: Angene
SKU: AG001RHN
Rating: 90 (10 reviews)

Carbamic acid, N-[(1R)-3-chloro-2-oxo-1-[(phenylthio)methyl]propyl]-, phenylmethyl ester

CAS No.:

159878-01-0

Catalog Number:

AG001RHN

Molecular Formula:

C18H18ClNO3S

Molecular Weight:

363.8584

Catalog Number:

AG001RHN

Chemical Name:

Carbamic acid, N-[(1R)-3-chloro-2-oxo-1-[(phenylthio)methyl]propyl]-, phenylmethyl ester

CAS Number:

159878-01-0

Molecular Formula:

C18H18ClNO3S

Molecular Weight:

363.8584

MDL Number:

MFCD09750996

IUPAC Name:

benzyl N-[(2R)-4-chloro-3-oxo-1-phenylsulfanylbutan-2-yl]carbamate

InChI:

InChI=1S/C18H18ClNO3S/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/h1-10,16H,11-13H2,(H,20,22)/t16-/m0/s1

InChI Key:

GHOXYLYITXKSDS-INIZCTEOSA-N

SMILES:

ClCC(=O)[C@@H](NC(=O)OCc1ccccc1)CSc1ccccc1

Complexity:

396

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

363.07g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

363.856g/mol

Monoisotopic Mass:

363.07g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1