2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-6-{[4-(4-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-6-{[4-(4-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-6-{[4-(4-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V023-5991 |
| Compound Name: | 2-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]-6-{[4-(4-methylphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 466.63 |
| Molecular Formula: | C26 H38 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)N1CCN(CC1)CC1=CC(NC(=N1)N1CCN(CC1)C(CC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9655 |
| logD: | 1.464 |
| logSw: | -3.211 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.556 |
| InChI Key: | RLVYVYBUBWIZHT-UHFFFAOYSA-N |