4-benzoyl-2,5-dimethoxy-N-{2-[(2-nitrophenyl)sulfanyl]phenyl}benzamide
Chemical Structure Depiction of
4-benzoyl-2,5-dimethoxy-N-{2-[(2-nitrophenyl)sulfanyl]phenyl}benzamide
4-benzoyl-2,5-dimethoxy-N-{2-[(2-nitrophenyl)sulfanyl]phenyl}benzamide
Compound characteristics
| Compound ID: | 8004-7668 |
| Compound Name: | 4-benzoyl-2,5-dimethoxy-N-{2-[(2-nitrophenyl)sulfanyl]phenyl}benzamide |
| Molecular Weight: | 514.56 |
| Molecular Formula: | C28 H22 N2 O6 S |
| Smiles: | COc1cc(C(Nc2ccccc2Sc2ccccc2[N+]([O-])=O)=O)c(cc1C(c1ccccc1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 6.7314 |
| logD: | 6.7314 |
| logSw: | -5.6989 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.169 |
| InChI Key: | BOUMZUJJMRTANT-UHFFFAOYSA-N |