3-({N-[(furan-2-yl)methyl]-4-(trifluoromethyl)benzamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
3-({N-[(furan-2-yl)methyl]-4-(trifluoromethyl)benzamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
3-({N-[(furan-2-yl)methyl]-4-(trifluoromethyl)benzamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V001-6390 |
| Compound Name: | 3-({N-[(furan-2-yl)methyl]-4-(trifluoromethyl)benzamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 583.51 |
| Molecular Formula: | C27 H19 F6 N O5 S |
| Smiles: | C(c1cccc(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)N(Cc1ccco1)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1254 |
| logD: | 6.1254 |
| logSw: | -6.272 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.688 |
| InChI Key: | NGIOKPSALYSPSG-UHFFFAOYSA-N |