1-(1,3-benzothiazol-2-yl)-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
1-(1,3-benzothiazol-2-yl)-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thiol
1-(1,3-benzothiazol-2-yl)-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 4802-0283 |
| Compound Name: | 1-(1,3-benzothiazol-2-yl)-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 324.42 |
| Molecular Formula: | C16 H12 N4 S2 |
| Smiles: | Cc1ccc(cc1)c1nc(nn1c1nc2ccccc2s1)S |
| Stereo: | ACHIRAL |
| logP: | 5.0612 |
| logD: | 4.2565 |
| logSw: | -4.7756 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.0232 |
| InChI Key: | OQDCPGWDAITEMV-UHFFFAOYSA-N |