ethyl 1-{4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzoyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzoyl}piperidine-3-carboxylate
ethyl 1-{4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzoyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | K788-4806 |
| Compound Name: | ethyl 1-{4-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzoyl}piperidine-3-carboxylate |
| Molecular Weight: | 420.46 |
| Molecular Formula: | C24 H24 N2 O5 |
| Smiles: | CCOC(C1CCCN(C1)C(c1ccc(/C=C2/C(Nc3ccccc3O2)=O)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2516 |
| logD: | 3.2516 |
| logSw: | -3.622 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.143 |
| InChI Key: | QVSJTAZIQQJPOO-SFHVURJKSA-N |