9H-[1,2,4]triazolo[4,3-a]benzimidazole-3-thiol
Chemical Structure Depiction of
9H-[1,2,4]triazolo[4,3-a]benzimidazole-3-thiol
9H-[1,2,4]triazolo[4,3-a]benzimidazole-3-thiol
Compound characteristics
| Compound ID: | C456-0026 |
| Compound Name: | 9H-[1,2,4]triazolo[4,3-a]benzimidazole-3-thiol |
| Molecular Weight: | 190.22 |
| Molecular Formula: | C8 H6 N4 S |
| Smiles: | c1ccc2c(c1)[nH]c1nnc(n12)S |
| Stereo: | ACHIRAL |
| logP: | 1.7492 |
| logD: | -0.6985 |
| logSw: | -1.9485 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.658 |
| InChI Key: | BJNKXZQNKYMVMM-UHFFFAOYSA-N |