ethyl 2-({[3-(methoxycarbonyl)phenyl]methyl}sulfanyl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-({[3-(methoxycarbonyl)phenyl]methyl}sulfanyl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
ethyl 2-({[3-(methoxycarbonyl)phenyl]methyl}sulfanyl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V008-5038 |
| Compound Name: | ethyl 2-({[3-(methoxycarbonyl)phenyl]methyl}sulfanyl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 528.55 |
| Molecular Formula: | C27 H23 F3 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2Cc1ccc(cc1)C(F)(F)F)SCc1cccc(c1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2398 |
| logD: | 7.2327 |
| logSw: | -5.7373 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.405 |
| InChI Key: | MHMKVSCKUKCNCH-UHFFFAOYSA-N |