5-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
5-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
5-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-6762 |
| Compound Name: | 5-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 541.52 |
| Molecular Formula: | C25 H23 F4 N O6 S |
| Smiles: | COCCN(Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.997 |
| logD: | 3.997 |
| logSw: | -4.2083 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.249 |
| InChI Key: | OAKOLOHLRQJGNJ-UHFFFAOYSA-N |