Name: Name:2-({[methyl(phenyl)carbamoyl]methyl}sulfanyl)acetic acid
Brand: Angene
SKU: AG019JBB
Rating: 90 (10 reviews)

2-({[methyl(phenyl)carbamoyl]methyl}sulfanyl)acetic acid

CAS No.:

790232-20-1

Catalog Number:

AG019JBB

Molecular Formula:

C11H13NO3S

Molecular Weight:

239.2908

Catalog Number:

AG019JBB

Chemical Name:

2-({[methyl(phenyl)carbamoyl]methyl}sulfanyl)acetic acid

CAS Number:

790232-20-1

Molecular Formula:

C11H13NO3S

Molecular Weight:

239.2908

MDL Number:

MFCD06356469

IUPAC Name:

2-[2-(N-methylanilino)-2-oxoethyl]sulfanylacetic acid

InChI:

InChI=1S/C11H13NO3S/c1-12(9-5-3-2-4-6-9)10(13)7-16-8-11(14)15/h2-6H,7-8H2,1H3,(H,14,15)

InChI Key:

NFMPZTXQFHPDNK-UHFFFAOYSA-N

SMILES:

CN(c1ccccc1)C(=O)CSCC(=O)O

Complexity:

252

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

239.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

239.289g/mol

Monoisotopic Mass:

239.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6