Molecule ID: 45266896

IUPAC Name: 6-[[2-(3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)acetyl]amino]hexanoic acid

Description: The molecule is a monocarboxylic acid amide, being a derivative of (3,5-dioxopyrazolidin-4-yl)acetamide substituted at nitrogen by a 5-carboxypentyl chain. It is a member of pyrazolidines and a monocarboxylic acid amide.

SMILES: O=C(O)CCCCCN=C(O)CC1C(=O)N(c2ccccc2)N(c2ccccc2)C1=O

SELFIES: [O][=C][Branch1][C][O][C][C][C][C][C][N][=C][Branch1][C][O][C][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][C][=O]

InChI: InChI=1S/C23H25N3O5/c27-20(24-15-9-3-8-14-21(28)29)16-19-22(30)25(17-10-4-1-5-11-17)26(23(19)31)18-12-6-2-7-13-18/h1-2,4-7,10-13,19H,3,8-9,14-16H2,(H,24,27)(H,28,29)

Molecular Properties:
- Polar Surface Area: 107.0 Ų
- LogP: 2.3