3-{[2,4-dimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
3-{[2,4-dimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
3-{[2,4-dimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V002-2555 |
| Compound Name: | 3-{[2,4-dimethoxy-N-(propan-2-yl)benzamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 537.55 |
| Molecular Formula: | C26 H26 F3 N O6 S |
| Smiles: | CC(C)N(Cc1cccc(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)C(c1ccc(cc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2875 |
| logD: | 5.2875 |
| logSw: | -5.5229 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.129 |
| InChI Key: | MFNDXRGORRXJFS-UHFFFAOYSA-N |