ethyl 2-({[3,5-bis(trifluoromethyl)phenyl]methyl}sulfanyl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-({[3,5-bis(trifluoromethyl)phenyl]methyl}sulfanyl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
ethyl 2-({[3,5-bis(trifluoromethyl)phenyl]methyl}sulfanyl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V011-6356 |
| Compound Name: | ethyl 2-({[3,5-bis(trifluoromethyl)phenyl]methyl}sulfanyl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 606.51 |
| Molecular Formula: | C27 H19 F9 N2 O2 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2Cc1ccc(cc1)C(F)(F)F)SCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 8.8086 |
| logD: | 8.8015 |
| logSw: | -5.772 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.2311 |
| InChI Key: | LYGSABLPZVDZLY-UHFFFAOYSA-N |