2-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-5-[(3-fluorophenyl)methoxy]-4H-pyran-4-one
Chemical Structure Depiction of
2-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-5-[(3-fluorophenyl)methoxy]-4H-pyran-4-one
2-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-5-[(3-fluorophenyl)methoxy]-4H-pyran-4-one
Compound characteristics
| Compound ID: | V004-3526 |
| Compound Name: | 2-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-5-[(3-fluorophenyl)methoxy]-4H-pyran-4-one |
| Molecular Weight: | 480.49 |
| Molecular Formula: | C26 H25 F N2 O6 |
| Smiles: | C1CN(CCN1CC1=CC(C(=CO1)OCc1cccc(c1)F)=O)C(C1COc2ccccc2O1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6946 |
| logD: | 2.6936 |
| logSw: | -2.8942 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.776 |
| InChI Key: | JDWOFCVWRBBRRU-VWLOTQADSA-N |