4-(3-chloro-4-fluorophenyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(3-chloro-4-fluorophenyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
4-(3-chloro-4-fluorophenyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8017-9685 |
| Compound Name: | 4-(3-chloro-4-fluorophenyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 436.9 |
| Molecular Formula: | C21 H14 Cl F N6 S |
| Smiles: | C(c1nnc(n1c1ccc(c(c1)[Cl])F)S)n1c2ccccc2nc1c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.8569 |
| logD: | 2.5976 |
| logSw: | -4.2118 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.41 |
| InChI Key: | GKHFYZUOVGDORR-UHFFFAOYSA-N |