ethyl 2-{[(2,3,5,6-tetrafluoro-4-methoxyphenyl)methyl]sulfanyl}-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{[(2,3,5,6-tetrafluoro-4-methoxyphenyl)methyl]sulfanyl}-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
ethyl 2-{[(2,3,5,6-tetrafluoro-4-methoxyphenyl)methyl]sulfanyl}-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V011-9033 |
| Compound Name: | ethyl 2-{[(2,3,5,6-tetrafluoro-4-methoxyphenyl)methyl]sulfanyl}-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 572.5 |
| Molecular Formula: | C26 H19 F7 N2 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2Cc1ccc(cc1)C(F)(F)F)SCc1c(c(c(c(c1F)F)OC)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 8.3312 |
| logD: | 8.3305 |
| logSw: | -5.7282 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.948 |
| InChI Key: | BJPKQTJXVUMJPU-UHFFFAOYSA-N |