L-3-(Benzylthio)-N-(phenylacetyl)alanine

3-benzylsulfanyl-2-[(2-phenylacetyl)amino]propanoic acid

CAS: 5411-82-5

Molecular Formula	`C18H19NO3S`
Molecular Weight	329.4 g/mol
LogP	2.9
Topological Polar Surface Area	91.7 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	329.10855
Heavy Atoms	23
Complexity	376.0

Chemical Identifiers

CAS Number	5411-82-5
SMILES	`C1=CC=C(C=C1)CC(=O)NC(CSCC2=CC=CC=C2)C(=O)O`
InChIKey	`QPJDYFJSCDMPOG-UHFFFAOYSA-N`

📖 Product Overview

L-3-(Benzylthio)-N-(phenylacetyl)alanine (CAS: 5411-82-5) is a chemical compound with molecular formula C18H19NO3S and molecular weight 329.4 g/mol. Its IUPAC systematic name is 3-benzylsulfanyl-2-[(2-phenylacetyl)amino]propanoic acid. LogP 2.9 Topological Polar Surface Area 91.7 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 329.10855 Heavy Atoms 23 Complexity 376.0 InChI Key: QPJDYFJSCDMPOG-UHFFFAOYSA-N. SMILES: C1=CC=C(C=C1)CC(=O)NC(CSCC2=CC=CC=C2)C(=O)O.

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