2-[1-(ethoxycarbonyl)piperidin-4-yl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Chemical Structure Depiction of
2-[1-(ethoxycarbonyl)piperidin-4-yl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
2-[1-(ethoxycarbonyl)piperidin-4-yl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Compound characteristics
| Compound ID: | C429-0060 |
| Compound Name: | 2-[1-(ethoxycarbonyl)piperidin-4-yl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid |
| Molecular Weight: | 346.34 |
| Molecular Formula: | C17 H18 N2 O6 |
| Smiles: | CCOC(N1CCC(CC1)N1C(c2ccc(cc2C1=O)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.866 |
| logD: | -1.1116 |
| logSw: | -2.9978 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.901 |
| InChI Key: | NMUCBRLMURKMQH-UHFFFAOYSA-N |