Molecule ID: 2801756

IUPAC Name: 7-chlorotetrazolo[5,1-c][1,2,4]benzotriazine

Description: The molecule is an organic heterotricyclic compound that is tetrazolo[5,1-c][1,2,4]benzotriazine substituted at position 7 by a chloro group. An antifungal and chemosensitising agent that induces oxidative stress in yeast and filamentous fungi and enhances the cytotoxic activity of 5-fluorocytosine and azole antimycotics. It has a role as an antifungal agent. It is an organic heterotricyclic compound and an organochlorine compound.

SMILES: Clc1ccc2c(c1)nnc1nnnn12

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

InChI: InChI=1S/C7H3ClN6/c8-4-1-2-6-5(3-4)9-10-7-11-12-13-14(6)7/h1-3H

Molecular Properties:
- Polar Surface Area: 68.9 Ų
- LogP: 0.7