5-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzene-1,3-dicarboxylic acid
Chemical Structure Depiction of
5-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzene-1,3-dicarboxylic acid
5-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzene-1,3-dicarboxylic acid
Compound characteristics
| Compound ID: | 2372-3992 |
| Compound Name: | 5-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzene-1,3-dicarboxylic acid |
| Molecular Weight: | 448.34 |
| Molecular Formula: | C22 H12 N2 O9 |
| Smiles: | c1cc(ccc1[N+]([O-])=O)Oc1ccc2C(N(C(c2c1)=O)c1cc(cc(c1)C(O)=O)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3364 |
| logD: | 1.1695 |
| logSw: | -4.4138 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 125.825 |
| InChI Key: | LSJHCOUZCILFBZ-UHFFFAOYSA-N |