ethyl 1-[3,4-dioxo-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-1-en-1-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[3,4-dioxo-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-1-en-1-yl]piperidine-4-carboxylate
ethyl 1-[3,4-dioxo-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-1-en-1-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | E786-0896 |
| Compound Name: | ethyl 1-[3,4-dioxo-2-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-7-yl)cyclobut-1-en-1-yl]piperidine-4-carboxylate |
| Molecular Weight: | 384.39 |
| Molecular Formula: | C20 H20 N2 O6 |
| Smiles: | CCOC(C1CCN(CC1)C1=C(C(C1=O)=O)c1ccc2c(c1)OCC(N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8394 |
| logD: | 1.8394 |
| logSw: | -2.4898 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.177 |
| InChI Key: | AGVSKDACLQUGKV-UHFFFAOYSA-N |