4-{[4-(3-fluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[4-(3-fluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
4-{[4-(3-fluorobenzoyl)piperazin-1-yl]methyl}-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0184 |
| Compound Name: | 4-{[4-(3-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(c3cccc(c3)F)=O)=CC(=O)Oc2c1 |
| Stereo: | ACHIRAL |
| logP: | 2.6479 |
| logD: | 2.6467 |
| logSw: | -3.0963 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.834 |
| InChI Key: | NWRASEKNDQSAPO-UHFFFAOYSA-N |