3-{[2-(4-methylphenoxy)ethyl]sulfanyl}-9-(2-phenoxyethyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Chemical Structure Depiction of
3-{[2-(4-methylphenoxy)ethyl]sulfanyl}-9-(2-phenoxyethyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
3-{[2-(4-methylphenoxy)ethyl]sulfanyl}-9-(2-phenoxyethyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole
Compound characteristics
| Compound ID: | 6386-0007 |
| Compound Name: | 3-{[2-(4-methylphenoxy)ethyl]sulfanyl}-9-(2-phenoxyethyl)-9H-[1,2,4]triazolo[4,3-a]benzimidazole |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C25 H24 N4 O2 S |
| Smiles: | Cc1ccc(cc1)OCCSc1nnc2n(CCOc3ccccc3)c3ccccc3n12 |
| Stereo: | ACHIRAL |
| logP: | 5.4822 |
| logD: | 5.478 |
| logSw: | -5.5156 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.469 |
| InChI Key: | ZXEMVCIRGDHFOS-UHFFFAOYSA-N |