Molecule ID: 25193530

IUPAC Name: 4-(4-chlorophenyl)-N-(cyclopentylideneamino)-1,3-thiazol-2-amine

Description: The molecule is a member of the class of 1,3-thiazole bearing 2-cyclopentylidenehydrazino and 4-chlorophenyl substituents at positions 2 and 4 respectively. It has a role as an EC 2.3.1.48 (histone acetyltransferase) inhibitor. It is a member of 1,3-thiazoles, a hydrazone and a member of monochlorobenzenes.

SMILES: Clc1ccc(-c2csc(NN=C3CCCC3)n2)cc1

SELFIES: [Cl][C][=C][C][=C][Branch2][Ring1][Ring1][C][=C][S][C][Branch1][#Branch2][N][N][=C][C][C][C][C][Ring1][Branch1][=N][Ring1][N][C][=C][Ring2][Ring1][C]

InChI: InChI=1S/C14H14ClN3S/c15-11-7-5-10(6-8-11)13-9-19-14(16-13)18-17-12-3-1-2-4-12/h5-9H,1-4H2,(H,16,18)

Molecular Properties:
- Polar Surface Area: 65.5 Ų
- LogP: 4.2