ethyl 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxylate
ethyl 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C700-0429 |
| Compound Name: | ethyl 1-[4-({4-[(3-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene}methyl)benzoyl]piperidine-4-carboxylate |
| Molecular Weight: | 524.62 |
| Molecular Formula: | C32 H32 N2 O5 |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccc(\C=C2/C(N(Cc3cccc(C)c3)c3ccccc3O2)=O)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4858 |
| logD: | 5.4858 |
| logSw: | -5.3904 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.435 |
| InChI Key: | ORQDXFATIWCTKV-UHFFFAOYSA-N |