6-ethyl-4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethyl-4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-2H-1-benzopyran-2-one
6-ethyl-4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3918 |
| Compound Name: | 6-ethyl-4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-7-hydroxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 382.43 |
| Molecular Formula: | C22 H23 F N2 O3 |
| Smiles: | CCc1cc2C(CN3CCN(CC3)c3ccc(cc3)F)=CC(=O)Oc2cc1O |
| Stereo: | ACHIRAL |
| logP: | 3.4433 |
| logD: | 3.3922 |
| logSw: | -3.3936 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.187 |
| InChI Key: | VJXNEMLVHOVAOW-UHFFFAOYSA-N |