2-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)pyrimidin-4(3H)-one
2-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | V023-2847 |
Compound Name: | 2-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-({4-[(4-methylphenyl)methyl]piperazin-1-yl}methyl)pyrimidin-4(3H)-one |
Molecular Weight: | 504.61 |
Molecular Formula: | C28 H33 F N6 O2 |
Smiles: | Cc1ccc(CN2CCN(CC2)CC2=CC(NC(=N2)N2CCN(CC2)C(c2ccc(cc2)F)=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 2.0774 |
logD: | 0.29 |
logSw: | -2.7703 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.092 |
InChI Key: | QAUPVXOTARXVAK-UHFFFAOYSA-N |