ethyl 1-(2-{[(1-ethylpyrrolidin-2-yl)methyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-{[(1-ethylpyrrolidin-2-yl)methyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperidine-3-carboxylate
ethyl 1-(2-{[(1-ethylpyrrolidin-2-yl)methyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | C738-0174 |
| Compound Name: | ethyl 1-(2-{[(1-ethylpyrrolidin-2-yl)methyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperidine-3-carboxylate |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C19 H29 N3 O4 |
| Smiles: | CCN1CCCC1CNC1=C(C(C1=O)=O)N1CCCC(C1)C(=O)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3876 |
| logD: | 0.6252 |
| logSw: | -1.6019 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.453 |
| InChI Key: | CUXXHYISCUDUEV-UHFFFAOYSA-N |