Molecule ID: 56927798

IUPAC Name: (2R)-2-[[(2R)-2-amino-2-phenylacetyl]amino]-N-butyl-3-sulfanylpropanamide

Description: The molecule is a dipeptide consisting of N-butyl-L-cysteinamide having an (R)-2-amino-2-phenylacetyl residue attached to its alpha-amino nitrogen. It is a dipeptide and a L-cysteine derivative.

SMILES: CCCCN=C(O)[C@H](CS)N=C(O)[C@H](N)c1ccccc1

SELFIES: [C][C][C][C][N][=C][Branch1][C][O][C@H1][Branch1][Ring1][C][S][N][=C][Branch1][C][O][C@H1][Branch1][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1]

InChI: InChI=1S/C15H23N3O2S/c1-2-3-9-17-14(19)12(10-21)18-15(20)13(16)11-7-5-4-6-8-11/h4-8,12-13,21H,2-3,9-10,16H2,1H3,(H,17,19)(H,18,20)/t12-,13+/m0/s1

Molecular Properties:
- Polar Surface Area: 85.2 Ų
- LogP: 1.2