N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide
N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V010-4443 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-3-nitro-N-{[4-(trifluoromethyl)phenyl]methyl}benzene-1-sulfonamide |
| Molecular Weight: | 496.46 |
| Molecular Formula: | C22 H19 F3 N2 O6 S |
| Smiles: | COc1ccc(cc1OC)N(Cc1ccc(cc1)C(F)(F)F)S(c1cccc(c1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8513 |
| logD: | 4.8513 |
| logSw: | -4.8049 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.435 |
| InChI Key: | LTYMIVGBGPKPTI-UHFFFAOYSA-N |