4-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
4-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
4-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-4078 |
| Compound Name: | 4-({ethyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 510.51 |
| Molecular Formula: | C24 H22 F4 N2 O4 S |
| Smiles: | CCNC(N(Cc1ccc(cc1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7338 |
| logD: | 4.7338 |
| logSw: | -4.5518 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.98 |
| InChI Key: | YQFFRKPDWJGDDM-UHFFFAOYSA-N |