Name: Name:4-(methylsulfanyl)-2-(2-phenylacetamido)butanoic acid
Brand: Angene
SKU: AG01AHOG
Rating: 90 (10 reviews)

4-(methylsulfanyl)-2-(2-phenylacetamido)butanoic acid

CAS No.:

2752-40-1

Catalog Number:

AG01AHOG

Molecular Formula:

C13H17NO3S

Molecular Weight:

267.3440

Catalog Number:

AG01AHOG

Chemical Name:

4-(methylsulfanyl)-2-(2-phenylacetamido)butanoic acid

CAS Number:

2752-40-1

Molecular Formula:

C13H17NO3S

Molecular Weight:

267.3440

MDL Number:

MFCD09802489

IUPAC Name:

4-methylsulfanyl-2-[(2-phenylacetyl)amino]butanoic acid

InChI:

InChI=1S/C13H17NO3S/c1-18-8-7-11(13(16)17)14-12(15)9-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,14,15)(H,16,17)

InChI Key:

OZQCZEAFOVHVSC-UHFFFAOYSA-N

SMILES:

CSCCC(C(=O)O)NC(=O)Cc1ccccc1

Complexity:

277

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

267.093g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

267.343g/mol

Monoisotopic Mass:

267.093g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2