2-[3-(butoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Chemical Structure Depiction of
2-[3-(butoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-[3-(butoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Compound characteristics
| Compound ID: | 0627-0183 |
| Compound Name: | 2-[3-(butoxycarbonyl)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid |
| Molecular Weight: | 367.36 |
| Molecular Formula: | C20 H17 N O6 |
| Smiles: | CCCCOC(c1cccc(c1)N1C(c2ccc(cc2C1=O)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3892 |
| logD: | 0.4116 |
| logSw: | -4.1364 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.336 |
| InChI Key: | MUAXKNQLZVTRRY-UHFFFAOYSA-N |