8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-4,5-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-4,5-dimethyl-2H-1-benzopyran-2-one
8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-4,5-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D355-0157 |
| Compound Name: | 8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-4,5-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 382.43 |
| Molecular Formula: | C22 H23 F N2 O3 |
| Smiles: | CC1=CC(=O)Oc2c(CN3CCN(CC3)c3ccc(cc3)F)c(cc(C)c12)O |
| Stereo: | ACHIRAL |
| logP: | 3.4533 |
| logD: | 3.3835 |
| logSw: | -3.6665 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.871 |
| InChI Key: | BMDBQRSHFAJNSU-UHFFFAOYSA-N |