ethyl 1-(6-nitro-1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindol-5-yl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(6-nitro-1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindol-5-yl)piperidine-3-carboxylate
ethyl 1-(6-nitro-1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindol-5-yl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | K906-0376 |
| Compound Name: | ethyl 1-(6-nitro-1,3-dioxo-2-phenyl-2,3-dihydro-1H-isoindol-5-yl)piperidine-3-carboxylate |
| Molecular Weight: | 423.42 |
| Molecular Formula: | C22 H21 N3 O6 |
| Smiles: | CCOC(C1CCCN(C1)c1cc2C(N(C(c2cc1[N+]([O-])=O)=O)c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2517 |
| logD: | 3.2517 |
| logSw: | -3.728 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.799 |
| InChI Key: | WWDXZUIHFBWEEK-AWEZNQCLSA-N |