3-(benzylsulfanyl)-9-(2-phenoxyethyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-9-(2-phenoxyethyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
3-(benzylsulfanyl)-9-(2-phenoxyethyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Compound characteristics
| Compound ID: | C456-0061 |
| Compound Name: | 3-(benzylsulfanyl)-9-(2-phenoxyethyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C23 H20 N4 O S |
| Smiles: | C(COc1ccccc1)n1c2ccccc2n2c(nnc12)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.906 |
| logD: | 4.9055 |
| logSw: | -4.8554 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.052 |
| InChI Key: | CPVBFAPCYYMJNH-UHFFFAOYSA-N |