9-benzyl-3-(ethylsulfanyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Chemical Structure Depiction of
9-benzyl-3-(ethylsulfanyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
9-benzyl-3-(ethylsulfanyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Compound characteristics
| Compound ID: | C456-0052 |
| Compound Name: | 9-benzyl-3-(ethylsulfanyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole |
| Molecular Weight: | 308.4 |
| Molecular Formula: | C17 H16 N4 S |
| Smiles: | CCSc1nnc2n(Cc3ccccc3)c3ccccc3n12 |
| Stereo: | ACHIRAL |
| logP: | 3.8861 |
| logD: | 3.7733 |
| logSw: | -3.8918 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.927 |
| InChI Key: | POWWYUNTQCIEQU-UHFFFAOYSA-N |