5-[(2-chlorophenyl)methoxy]-2-{[4-(2-methylbutanoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Chemical Structure Depiction of
5-[(2-chlorophenyl)methoxy]-2-{[4-(2-methylbutanoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
5-[(2-chlorophenyl)methoxy]-2-{[4-(2-methylbutanoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Compound characteristics
| Compound ID: | V010-9366 |
| Compound Name: | 5-[(2-chlorophenyl)methoxy]-2-{[4-(2-methylbutanoyl)piperazin-1-yl]methyl}-4H-pyran-4-one |
| Molecular Weight: | 418.92 |
| Molecular Formula: | C22 H27 Cl N2 O4 |
| Smiles: | CCC(C)C(N1CCN(CC1)CC1=CC(C(=CO1)OCc1ccccc1[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9176 |
| logD: | 2.9164 |
| logSw: | -3.3137 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.611 |
| InChI Key: | OOBUJXRGVVOJFN-INIZCTEOSA-N |