4-[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]benzoic acid
Chemical Structure Depiction of
4-[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]benzoic acid
4-[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]benzoic acid
Compound characteristics
| Compound ID: | 8009-3199 |
| Compound Name: | 4-[2-(2-methylpropyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carbonyl]benzoic acid |
| Molecular Weight: | 351.36 |
| Molecular Formula: | C20 H17 N O5 |
| Smiles: | CC(C)CN1C(c2ccc(cc2C1=O)C(c1ccc(cc1)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9579 |
| logD: | 0.3511 |
| logSw: | -4.0024 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.638 |
| InChI Key: | DCUYHWMCTBUCSN-UHFFFAOYSA-N |