2-[4-(2-ethylhexanoyl)piperazin-1-yl]-6-{[4-(4-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[4-(2-ethylhexanoyl)piperazin-1-yl]-6-{[4-(4-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
2-[4-(2-ethylhexanoyl)piperazin-1-yl]-6-{[4-(4-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V017-3835 |
| Compound Name: | 2-[4-(2-ethylhexanoyl)piperazin-1-yl]-6-{[4-(4-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 494.68 |
| Molecular Formula: | C28 H42 N6 O2 |
| Salt: | not_available |
| Smiles: | CCCCC(CC)C(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)c2ccc(C)cc2)N=1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9956 |
| logD: | 2.4941 |
| logSw: | -3.9325 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.083 |
| InChI Key: | KQTPTBQWEYJDRL-QHCPKHFHSA-N |