2-(4-chlorophenyl)-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-6-methylpyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-6-methylpyrimidin-4(3H)-one
2-(4-chlorophenyl)-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-6-methylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | P196-1118 |
| Compound Name: | 2-(4-chlorophenyl)-3-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-6-methylpyrimidin-4(3H)-one |
| Molecular Weight: | 440.9 |
| Molecular Formula: | C23 H22 Cl F N4 O2 |
| Smiles: | CC1=CC(N(CC(N2CCN(CC2)c2ccc(cc2)F)=O)C(c2ccc(cc2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1503 |
| logD: | 3.1495 |
| logSw: | -3.5497 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.136 |
| InChI Key: | LBMQTLVQAGSJHL-UHFFFAOYSA-N |