ethyl 1-{3,4-dioxo-2-[4-(propan-2-yl)anilino]cyclobut-1-en-1-yl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{3,4-dioxo-2-[4-(propan-2-yl)anilino]cyclobut-1-en-1-yl}piperidine-4-carboxylate
ethyl 1-{3,4-dioxo-2-[4-(propan-2-yl)anilino]cyclobut-1-en-1-yl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C667-0255 |
| Compound Name: | ethyl 1-{3,4-dioxo-2-[4-(propan-2-yl)anilino]cyclobut-1-en-1-yl}piperidine-4-carboxylate |
| Molecular Weight: | 370.45 |
| Molecular Formula: | C21 H26 N2 O4 |
| Smiles: | CCOC(C1CCN(CC1)C1=C(C(C1=O)=O)Nc1ccc(cc1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9417 |
| logD: | 3.9201 |
| logSw: | -3.7839 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.29 |
| InChI Key: | APROAJKTVLAKJD-UHFFFAOYSA-N |