3-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
3-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D715-2718 |
| Compound Name: | 3-{3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl}-7-hydroxy-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 410.44 |
| Molecular Formula: | C23 H23 F N2 O4 |
| Smiles: | CC1=C(CCC(N2CCN(CC2)c2ccccc2F)=O)C(=O)Oc2cc(ccc12)O |
| Stereo: | ACHIRAL |
| logP: | 3.0307 |
| logD: | 3.0015 |
| logSw: | -3.3499 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.857 |
| InChI Key: | XNEDVDNOUWGHLD-UHFFFAOYSA-N |