5-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzene-1,3-dicarboxylic acid
Chemical Structure Depiction of
5-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzene-1,3-dicarboxylic acid
5-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzene-1,3-dicarboxylic acid
Compound characteristics
| Compound ID: | 2372-2244 |
| Compound Name: | 5-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzene-1,3-dicarboxylic acid |
| Molecular Weight: | 475.37 |
| Molecular Formula: | C23 H13 N3 O9 |
| Smiles: | c1cc(ccc1C(Nc1cc(cc(c1)C(O)=O)C(O)=O)=O)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7028 |
| logD: | 0.3395 |
| logSw: | -4.0962 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 142.169 |
| InChI Key: | SRHMBMBZLKOSHS-UHFFFAOYSA-N |