2-(4-heptanoylpiperazin-1-yl)-6-{[4-(2-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(4-heptanoylpiperazin-1-yl)-6-{[4-(2-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
2-(4-heptanoylpiperazin-1-yl)-6-{[4-(2-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V017-8942 |
| Compound Name: | 2-(4-heptanoylpiperazin-1-yl)-6-{[4-(2-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 480.65 |
| Molecular Formula: | C27 H40 N6 O2 |
| Smiles: | CCCCCCC(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)c2ccccc2C)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.63 |
| logD: | 1.4229 |
| logSw: | -3.6207 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.255 |
| InChI Key: | DOJWLGMNAWSDML-UHFFFAOYSA-N |