ethyl 6-{[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl}-2-oxo-4-{4-[(propan-2-yl)oxy]phenyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-{[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl}-2-oxo-4-{4-[(propan-2-yl)oxy]phenyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-{[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl}-2-oxo-4-{4-[(propan-2-yl)oxy]phenyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C430-5441 |
| Compound Name: | ethyl 6-{[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl}-2-oxo-4-{4-[(propan-2-yl)oxy]phenyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 515.01 |
| Molecular Formula: | C25 H31 Cl N6 O4 |
| Smiles: | CCOC(C1C(c2ccc(cc2)OC(C)C)NC(NC=1CN1CCN(CC1)c1ccc(nn1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4672 |
| logD: | 2.4672 |
| logSw: | -3.5586 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.921 |
| InChI Key: | MCHTXRJAHSNWNB-HSZRJFAPSA-N |