3-({[(4-Methylphenyl)carbamoyl]methyl}sulfanyl)propanoic acid structure

3-({[(4-Methylphenyl)carbamoyl]methyl}sulfanyl)propanoic acid

3-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanoic acid

Also Known As: 3-({[(4-methylphenyl)carbamoyl]methyl}sulfanyl)propanoic acid|3-({2-[(4-methylphenyl)amino]-2-oxoethyl}thio)propanoic acid|3-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanoic acid|SR-01000058952-1|3-[(4-methylphenyl)carbamoylmethylsulfanyl]propanoic Acid|3-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylpropanoic acid|3-({[(4-methylphenyl)carbamoyl]methyl}sulfanyl)propanoicacid

CAS: 397290-81-2
Molecular Formula C12H15NO3S
Molecular Weight 253.07727 g/mol
LogP 2.14142
Topological Polar Surface Area 66.4 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
Rotatable Bonds 6
Exact Mass 253.07727
Monoisotopic Mass 253.07727
Heavy Atoms 17
Complexity 389.24216

Chemical Identifiers

CAS Number 397290-81-2
SMILES CC1=CC=C(C=C1)NC(=O)CSCCC(=O)O

Product Overview

3-({[(4-Methylphenyl)carbamoyl]methyl}sulfanyl)propanoic acid (CAS 397290-81-2), with molecular formula C12H15NO3S and molecular weight 253.07727 g/mol. IUPAC: 3-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanoic acid.

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