dimethyl 5-[(3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carbonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carbonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carbonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C447-0478 |
| Compound Name: | dimethyl 5-[(3-oxo-2-propyl-2,3-dihydro-1H-isoindole-4-carbonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 410.43 |
| Molecular Formula: | C22 H22 N2 O6 |
| Smiles: | CCCN1Cc2cccc(C(Nc3cc(cc(c3)C(=O)OC)C(=O)OC)=O)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.6502 |
| logD: | 3.6491 |
| logSw: | -4.056 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.574 |
| InChI Key: | CGGDZNJYWFBBRR-UHFFFAOYSA-N |