ethyl 4-{1-[4-(ethoxycarbonyl)anilino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{1-[4-(ethoxycarbonyl)anilino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
ethyl 4-{1-[4-(ethoxycarbonyl)anilino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C429-0359 |
| Compound Name: | ethyl 4-{1-[4-(ethoxycarbonyl)anilino]-3-oxo-1,3-dihydro-2H-isoindol-2-yl}piperidine-1-carboxylate |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC1c2ccccc2C(N1C1CCN(CC1)C(=O)OCC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.532 |
| logD: | 4.532 |
| logSw: | -4.1155 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.757 |
| InChI Key: | HAQVCXPYABTZDN-JOCHJYFZSA-N |