5-{[2-(2,3-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzene-1,3-dicarboxylic acid
Chemical Structure Depiction of
5-{[2-(2,3-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzene-1,3-dicarboxylic acid
5-{[2-(2,3-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzene-1,3-dicarboxylic acid
Compound characteristics
| Compound ID: | 4334-1159 |
| Compound Name: | 5-{[2-(2,3-dimethylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]amino}benzene-1,3-dicarboxylic acid |
| Molecular Weight: | 458.43 |
| Molecular Formula: | C25 H18 N2 O7 |
| Smiles: | Cc1cccc(c1C)N1C(c2ccc(cc2C1=O)C(Nc1cc(cc(c1)C(O)=O)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9684 |
| logD: | 1.6051 |
| logSw: | -4.3667 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 108.486 |
| InChI Key: | UOCCRQUSJCNLQH-UHFFFAOYSA-N |