8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-4-methyl-3-propyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-4-methyl-3-propyl-2H-1-benzopyran-2-one
8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-4-methyl-3-propyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D355-0534 |
| Compound Name: | 8-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-4-methyl-3-propyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C24 H27 F N2 O3 |
| Smiles: | CCCC1=C(C)c2ccc(c(CN3CCN(CC3)c3ccc(cc3)F)c2OC1=O)O |
| Stereo: | ACHIRAL |
| logP: | 4.8145 |
| logD: | 4.7895 |
| logSw: | -4.3155 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.385 |
| InChI Key: | AVDIVCMKWLODAW-UHFFFAOYSA-N |