5-[(2-chlorophenyl)methoxy]-2-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Chemical Structure Depiction of
5-[(2-chlorophenyl)methoxy]-2-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
5-[(2-chlorophenyl)methoxy]-2-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Compound characteristics
| Compound ID: | V005-0101 |
| Compound Name: | 5-[(2-chlorophenyl)methoxy]-2-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4H-pyran-4-one |
| Molecular Weight: | 496.95 |
| Molecular Formula: | C26 H25 Cl N2 O6 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1CC1=CC(C(=CO1)OCc1ccccc1[Cl])=O)C(C1COc2ccccc2O1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9973 |
| logD: | 2.9963 |
| logSw: | -3.3428 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.776 |
| InChI Key: | DDRGOHZVSNMTLA-VWLOTQADSA-N |