5-[(1H-benzimidazol-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[(1H-benzimidazol-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
5-[(1H-benzimidazol-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 6232-0264 |
| Compound Name: | 5-[(1H-benzimidazol-1-yl)methyl]-4-phenyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 307.37 |
| Molecular Formula: | C16 H13 N5 S |
| Smiles: | C(c1nnc(n1c1ccccc1)S)n1cnc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 1.799 |
| logD: | 1.799 |
| logSw: | -1.5402 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.89 |
| InChI Key: | NUPVMAUQPHWUKV-UHFFFAOYSA-N |