4-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
4-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | D222-0185 |
Compound Name: | 4-{[4-(4-fluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one |
Molecular Weight: | 380.42 |
Molecular Formula: | C22 H21 F N2 O3 |
Smiles: | Cc1ccc2C(CN3CCN(CC3)C(c3ccc(cc3)F)=O)=CC(=O)Oc2c1 |
Stereo: | ACHIRAL |
logP: | 2.6383 |
logD: | 2.6371 |
logSw: | -3.0795 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 40.834 |
InChI Key: | FMYNRBDGAKFJEI-UHFFFAOYSA-N |