3-(benzylsulfanyl)-9-ethyl-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-9-ethyl-9H-[1,2,4]triazolo[4,3-a]benzimidazole
3-(benzylsulfanyl)-9-ethyl-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Compound characteristics
| Compound ID: | C456-0045 |
| Compound Name: | 3-(benzylsulfanyl)-9-ethyl-9H-[1,2,4]triazolo[4,3-a]benzimidazole |
| Molecular Weight: | 308.4 |
| Molecular Formula: | C17 H16 N4 S |
| Smiles: | CCn1c2ccccc2n2c(nnc12)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5282 |
| logD: | 3.5255 |
| logSw: | -3.5335 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.6518 |
| InChI Key: | PDGCQHOPQFKCNY-UHFFFAOYSA-N |