2-(4-fluorophenyl)-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-fluorophenyl)-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
2-(4-fluorophenyl)-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | T604-0336 |
| Compound Name: | 2-(4-fluorophenyl)-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-(2-hydroxyethyl)-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 468.5 |
| Molecular Formula: | C25 H26 F2 N4 O3 |
| Smiles: | CC1=C(CCO)C(N(CC(N2CCN(CC2)c2ccc(cc2)F)=O)C(c2ccc(cc2)F)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8045 |
| logD: | 1.8035 |
| logSw: | -2.0849 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.31 |
| InChI Key: | DALGUAJTHRENFF-UHFFFAOYSA-N |