ethyl 1-(2-{[2-(azepan-1-yl)ethyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-{[2-(azepan-1-yl)ethyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperidine-3-carboxylate
ethyl 1-(2-{[2-(azepan-1-yl)ethyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | C738-0289 |
| Compound Name: | ethyl 1-(2-{[2-(azepan-1-yl)ethyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperidine-3-carboxylate |
| Molecular Weight: | 377.48 |
| Molecular Formula: | C20 H31 N3 O4 |
| Smiles: | CCOC(C1CCCN(C1)C1=C(C(C1=O)=O)NCCN1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9374 |
| logD: | 0.6962 |
| logSw: | -2.24 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.701 |
| InChI Key: | CZGJPFDKIGOQMD-HNNXBMFYSA-N |