ethyl 1-[(pyridin-2-yl)methyl]-2-{[(2,4,5-trifluorophenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 1-[(pyridin-2-yl)methyl]-2-{[(2,4,5-trifluorophenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
ethyl 1-[(pyridin-2-yl)methyl]-2-{[(2,4,5-trifluorophenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V006-0982 |
| Compound Name: | ethyl 1-[(pyridin-2-yl)methyl]-2-{[(2,4,5-trifluorophenyl)methyl]sulfanyl}-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 457.47 |
| Molecular Formula: | C23 H18 F3 N3 O2 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2Cc1ccccn1)SCc1cc(c(cc1F)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7863 |
| logD: | 5.617 |
| logSw: | -5.5601 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.774 |
| InChI Key: | WKRVFBVFFDWAMI-UHFFFAOYSA-N |