2-[3-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzoic acid
Chemical Structure Depiction of
2-[3-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzoic acid
2-[3-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamido]benzoic acid
Compound characteristics
| Compound ID: | 8008-9947 |
| Compound Name: | 2-[3-(4-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(c1cccc(c1)N1C(c2cccc(c2C1=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.756 |
| logD: | -2.0701 |
| logSw: | -3.566 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.762 |
| InChI Key: | TZZIMTGTYOGXIP-UHFFFAOYSA-N |