4-(1-phenylethyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(1-phenylethyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
4-(1-phenylethyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8018-1437 |
| Compound Name: | 4-(1-phenylethyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 412.52 |
| Molecular Formula: | C23 H20 N6 S |
| Smiles: | CC(c1ccccc1)n1c(Cn2c3ccccc3nc2c2ccccn2)nnc1S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9097 |
| logD: | 3.4921 |
| logSw: | -3.9588 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.363 |
| InChI Key: | AMXUEKXZHPBYEJ-INIZCTEOSA-N |