6-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-2-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-2-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]pyrimidin-4(3H)-one
6-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-2-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-6761 |
| Compound Name: | 6-{[4-(3-methylphenyl)piperazin-1-yl]methyl}-2-[4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]pyrimidin-4(3H)-one |
| Molecular Weight: | 508.71 |
| Molecular Formula: | C29 H44 N6 O2 |
| Salt: | not_available |
| Smiles: | CC(CC(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)c2cccc(C)c2)N=1)=O)=O)CC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.781 |
| logD: | 2.2795 |
| logSw: | -3.7797 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.556 |
| InChI Key: | YAMBAWRRWZKXKW-UHFFFAOYSA-N |