2-[4-(4-ethylbenzoyl)piperazin-1-yl]-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[4-(4-ethylbenzoyl)piperazin-1-yl]-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
2-[4-(4-ethylbenzoyl)piperazin-1-yl]-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V001-5613 |
| Compound Name: | 2-[4-(4-ethylbenzoyl)piperazin-1-yl]-6-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 516.64 |
| Molecular Formula: | C29 H36 N6 O3 |
| Salt: | not_available |
| Smiles: | CCc1ccc(cc1)C(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)c2ccc(cc2)OC)N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9785 |
| logD: | 1.477 |
| logSw: | -3.2923 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.356 |
| InChI Key: | VSZPIGQZYLJNCV-UHFFFAOYSA-N |