ethyl 6-{[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl}-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-{[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl}-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-{[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl}-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E777-0119 |
| Compound Name: | ethyl 6-{[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl}-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 470.96 |
| Molecular Formula: | C23 H27 Cl N6 O3 |
| Smiles: | CCOC(C1C(c2ccc(C)cc2)NC(NC=1CN1CCN(CC1)c1ccc(nn1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.224 |
| logD: | 2.224 |
| logSw: | -3.4086 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.118 |
| InChI Key: | JVCAIZDVOXNVLV-OAQYLSRUSA-N |