ethyl 2-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
ethyl 2-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate
Compound characteristics
| Compound ID: | V021-1739 |
| Compound Name: | ethyl 2-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]-1-{[4-(trifluoromethyl)phenyl]methyl}-1H-benzimidazole-5-carboxylate |
| Molecular Weight: | 521.56 |
| Molecular Formula: | C25 H26 F3 N3 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(c1ccc2c(c1)nc(n2Cc1ccc(cc1)C(F)(F)F)SCC(NCC1CCCO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7896 |
| logD: | 4.7861 |
| logSw: | -4.6181 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.357 |
| InChI Key: | BTVDZIMMEDKTJR-LJQANCHMSA-N |