2-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-6756 |
| Compound Name: | 2-({2-chloro-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 553.98 |
| Molecular Formula: | C26 H23 Cl F3 N O5 S |
| Smiles: | C1CC(CN(Cc2ccccc2OS(c2cccc(c2)C(F)(F)F)(=O)=O)C(c2ccccc2[Cl])=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0515 |
| logD: | 5.0515 |
| logSw: | -5.1444 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.68 |
| InChI Key: | CMVHTQOPDSDKGO-HXUWFJFHSA-N |