ethyl 4-{[2-(cyclooctylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[2-(cyclooctylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
ethyl 4-{[2-(cyclooctylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C748-0053 |
| Compound Name: | ethyl 4-{[2-(cyclooctylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}piperidine-1-carboxylate |
| Molecular Weight: | 377.48 |
| Molecular Formula: | C20 H31 N3 O4 |
| Smiles: | CCOC(N1CCC(CC1)NC1=C(C(C1=O)=O)NC1CCCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2395 |
| logD: | 3.2384 |
| logSw: | -3.3095 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.483 |
| InChI Key: | CGZHSPACIPDERE-UHFFFAOYSA-N |