2-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzoic acid
Chemical Structure Depiction of
2-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzoic acid
2-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzoic acid
Compound characteristics
| Compound ID: | 2372-2235 |
| Compound Name: | 2-[4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzoic acid |
| Molecular Weight: | 431.36 |
| Molecular Formula: | C22 H13 N3 O7 |
| Smiles: | c1ccc(c(c1)C(O)=O)NC(c1ccc(cc1)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7037 |
| logD: | -1.1224 |
| logSw: | -4.0028 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.063 |
| InChI Key: | XWNXMCLAUCXSRM-UHFFFAOYSA-N |