2-{4-[(octyloxy)carbonyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Chemical Structure Depiction of
2-{4-[(octyloxy)carbonyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-{4-[(octyloxy)carbonyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Compound characteristics
| Compound ID: | 0584-0007 |
| Compound Name: | 2-{4-[(octyloxy)carbonyl]phenyl}-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid |
| Molecular Weight: | 423.46 |
| Molecular Formula: | C24 H25 N O6 |
| Smiles: | CCCCCCCCOC(c1ccc(cc1)N1C(c2ccc(cc2C1=O)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4331 |
| logD: | 2.4556 |
| logSw: | -5.5034 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.336 |
| InChI Key: | RMSBMXMDRBQJEY-UHFFFAOYSA-N |