2-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-2651 |
| Compound Name: | 2-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 625.11 |
| Molecular Formula: | C30 H32 Cl F3 N2 O5 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CC2CCCO2)C(c2ccccc2[Cl])=O)c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8445 |
| logD: | 5.8337 |
| logSw: | -5.8059 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.417 |
| InChI Key: | ZRTIJDGRYQYGRW-XMMPIXPASA-N |