4-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
4-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
4-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-1724 |
| Compound Name: | 4-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 511.49 |
| Molecular Formula: | C24 H21 F4 N O5 S |
| Smiles: | COCCN(Cc1ccc(cc1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2601 |
| logD: | 4.2601 |
| logSw: | -4.3127 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.532 |
| InChI Key: | BTMDUGFIORNBIO-UHFFFAOYSA-N |