4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide
Chemical Structure Depiction of
4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide
4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide
Compound characteristics
| Compound ID: | 2372-2977 |
| Compound Name: | 4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{4-[(4-nitrophenyl)sulfanyl]phenyl}benzamide |
| Molecular Weight: | 540.51 |
| Molecular Formula: | C27 H16 N4 O7 S |
| Smiles: | c1cc(ccc1C(Nc1ccc(cc1)Sc1ccc(cc1)[N+]([O-])=O)=O)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.694 |
| logD: | 5.6939 |
| logSw: | -5.916 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 118.463 |
| InChI Key: | GJFKAJIVGVHZRK-UHFFFAOYSA-N |