Molecule ID: 771910

IUPAC Name: benzotriazol-1-yl-(2,4-dichlorophenyl)methanone

Description: The molecule is a member of the class of benzamides that is obtained by the formal condensation of 2,4-dichlorobenzoic acid and benzotriazole. It acts as an inhibitor for tubulin acetylation mediated by trichostatin A. It has a role as an inhibitor. It is a member of benzotriazoles, a member of benzamides and a dichlorobenzene. It derives from a 2,4-dichlorobenzoic acid and a benzotriazole.

SMILES: O=C(c1ccc(Cl)cc1Cl)n1nnc2ccccc21

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

InChI: InChI=1S/C13H7Cl2N3O/c14-8-5-6-9(10(15)7-8)13(19)18-12-4-2-1-3-11(12)16-17-18/h1-7H

Molecular Properties:
- Polar Surface Area: 47.8 Ų
- LogP: 3.9