5-({4-butyl-N-[(furan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
5-({4-butyl-N-[(furan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
5-({4-butyl-N-[(furan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V002-1352 |
| Compound Name: | 5-({4-butyl-N-[(furan-2-yl)methyl]benzamido}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 601.64 |
| Molecular Formula: | C31 H30 F3 N O6 S |
| Smiles: | CCCCc1ccc(cc1)C(N(Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9167 |
| logD: | 6.9167 |
| logSw: | -5.8068 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.405 |
| InChI Key: | XRBHOSHXYVHLSZ-UHFFFAOYSA-N |