N-[(3,4-dimethoxyphenyl)methyl]-N-(4-fluorophenyl)-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-N-(4-fluorophenyl)-3-nitrobenzene-1-sulfonamide
N-[(3,4-dimethoxyphenyl)methyl]-N-(4-fluorophenyl)-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V017-5654 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-N-(4-fluorophenyl)-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 446.45 |
| Molecular Formula: | C21 H19 F N2 O6 S |
| Smiles: | COc1ccc(CN(c2ccc(cc2)F)S(c2cccc(c2)[N+]([O-])=O)(=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.9537 |
| logD: | 3.9537 |
| logSw: | -4.1221 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.435 |
| InChI Key: | OIJBQHYFSIDDNU-UHFFFAOYSA-N |