ethyl 4-(2-chlorophenyl)-1-methyl-6-{[4-(3-methylbutanoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-chlorophenyl)-1-methyl-6-{[4-(3-methylbutanoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2-chlorophenyl)-1-methyl-6-{[4-(3-methylbutanoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V019-1095 |
| Compound Name: | ethyl 4-(2-chlorophenyl)-1-methyl-6-{[4-(3-methylbutanoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 477 |
| Molecular Formula: | C24 H33 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccccc2[Cl])NC(N(C)C=1CN1CCN(CC1)C(CC(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8589 |
| logD: | 2.0642 |
| logSw: | -3.4736 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.723 |
| InChI Key: | QCNDZENMLQUQAE-QFIPXVFZSA-N |