ethyl 4-[2-(4-benzylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[2-(4-benzylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]piperazine-1-carboxylate
ethyl 4-[2-(4-benzylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C748-1213 |
| Compound Name: | ethyl 4-[2-(4-benzylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]piperazine-1-carboxylate |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C23 H29 N3 O4 |
| Smiles: | CCOC(N1CCN(CC1)C1=C(C(C1=O)=O)N1CCC(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9859 |
| logD: | 3.9856 |
| logSw: | -3.9829 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.304 |
| InChI Key: | MBBAQPGZZUDNGM-UHFFFAOYSA-N |