ethyl 4-{[3,4-dioxo-2-(4-phenylpiperazin-1-yl)cyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[3,4-dioxo-2-(4-phenylpiperazin-1-yl)cyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
ethyl 4-{[3,4-dioxo-2-(4-phenylpiperazin-1-yl)cyclobut-1-en-1-yl]amino}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C748-0094 |
| Compound Name: | ethyl 4-{[3,4-dioxo-2-(4-phenylpiperazin-1-yl)cyclobut-1-en-1-yl]amino}piperidine-1-carboxylate |
| Molecular Weight: | 412.49 |
| Molecular Formula: | C22 H28 N4 O4 |
| Smiles: | CCOC(N1CCC(CC1)NC1=C(C(C1=O)=O)N1CCN(CC1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5245 |
| logD: | 2.5217 |
| logSw: | -2.5899 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.624 |
| InChI Key: | NXRKBVJUWBVACK-UHFFFAOYSA-N |