3-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(3-nitrophenyl)benzamide
Chemical Structure Depiction of
3-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(3-nitrophenyl)benzamide
3-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(3-nitrophenyl)benzamide
Compound characteristics
| Compound ID: | 8007-4155 |
| Compound Name: | 3-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(3-nitrophenyl)benzamide |
| Molecular Weight: | 432.35 |
| Molecular Formula: | C21 H12 N4 O7 |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)NC(c1cccc(c1)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7007 |
| logD: | 3.6601 |
| logSw: | -4.104 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 118.734 |
| InChI Key: | BEIIURGJHVQQRM-UHFFFAOYSA-N |