5-[(2-chlorophenyl)methoxy]-2-{[4-(3-phenylprop-2-enoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Chemical Structure Depiction of
5-[(2-chlorophenyl)methoxy]-2-{[4-(3-phenylprop-2-enoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
5-[(2-chlorophenyl)methoxy]-2-{[4-(3-phenylprop-2-enoyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Compound characteristics
| Compound ID: | V008-3038 |
| Compound Name: | 5-[(2-chlorophenyl)methoxy]-2-{[4-(3-phenylprop-2-enoyl)piperazin-1-yl]methyl}-4H-pyran-4-one |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C26 H25 Cl N2 O4 |
| Smiles: | C1CN(CCN1CC1=CC(C(=CO1)OCc1ccccc1[Cl])=O)C(/C=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5624 |
| logD: | 3.5621 |
| logSw: | -3.7634 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.812 |
| InChI Key: | RJLJWTWQSAYTNA-ZHACJKMWSA-N |