2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-0684 |
| Compound Name: | 2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 649.1 |
| Molecular Formula: | C32 H29 Cl F4 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(Cc2ccc(cc2)F)C(c2ccccc2[Cl])=O)c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1538 |
| logD: | 7.143 |
| logSw: | -6.2776 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.762 |
| InChI Key: | FUEHLZAOVYGIAJ-UHFFFAOYSA-N |