5-({N-[(furan-2-yl)methyl]-2-methylbenzamido}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
5-({N-[(furan-2-yl)methyl]-2-methylbenzamido}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
5-({N-[(furan-2-yl)methyl]-2-methylbenzamido}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-1011 |
| Compound Name: | 5-({N-[(furan-2-yl)methyl]-2-methylbenzamido}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 559.56 |
| Molecular Formula: | C28 H24 F3 N O6 S |
| Smiles: | Cc1ccccc1C(N(Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3381 |
| logD: | 5.3381 |
| logSw: | -5.5172 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.405 |
| InChI Key: | RIVZNGQXPPJYIY-UHFFFAOYSA-N |