ethyl 1-(3-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzoyl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(3-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzoyl)piperidine-3-carboxylate
ethyl 1-(3-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzoyl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | J077-1304 |
| Compound Name: | ethyl 1-(3-{3-[(4-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl}benzoyl)piperidine-3-carboxylate |
| Molecular Weight: | 483.99 |
| Molecular Formula: | C26 H30 Cl N3 O4 |
| Smiles: | CCOC(C1CCCN(C1)C(c1cccc(c1)N1CCCN(Cc2ccc(cc2)[Cl])C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8775 |
| logD: | 3.8775 |
| logSw: | -4.2558 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.132 |
| InChI Key: | YMDWCJLEFGGHQK-NRFANRHFSA-N |