4-{[4-(2,6-difluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(2,6-difluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
4-{[4-(2,6-difluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0162 |
| Compound Name: | 4-{[4-(2,6-difluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 398.41 |
| Molecular Formula: | C22 H20 F2 N2 O3 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)C(c3c(cccc3F)F)=O)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.8547 |
| logD: | 2.8535 |
| logSw: | -3.2889 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.834 |
| InChI Key: | WZJUAWABQSBNLM-UHFFFAOYSA-N |