ethyl 2-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}sulfanyl)-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}sulfanyl)-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
ethyl 2-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}sulfanyl)-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V008-6327 |
| Compound Name: | ethyl 2-({[4-chloro-2-(trifluoromethyl)quinolin-6-yl]methyl}sulfanyl)-1-[(pyridin-2-yl)methyl]-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 556.99 |
| Molecular Formula: | C27 H20 Cl F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2Cc1ccccn1)SCc1ccc2c(c1)c(cc(C(F)(F)F)n2)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.2087 |
| logD: | 7.0394 |
| logSw: | -6.4296 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.105 |
| InChI Key: | IHLMRQREACIPIU-UHFFFAOYSA-N |