ethyl 1-methyl-6-{[3-methyl-4-(2-methylpropanoyl)piperazin-1-yl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-methyl-6-{[3-methyl-4-(2-methylpropanoyl)piperazin-1-yl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-methyl-6-{[3-methyl-4-(2-methylpropanoyl)piperazin-1-yl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V016-9057 |
| Compound Name: | ethyl 1-methyl-6-{[3-methyl-4-(2-methylpropanoyl)piperazin-1-yl]methyl}-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C24 H34 N4 O4 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccccc2)NC(N(C)C=1CN1CCN(C(C)C1)C(C(C)C)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2952 |
| logD: | 1.3442 |
| logSw: | -2.7144 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.469 |
| InChI Key: | LIAQSPIOPZHWEO-UHFFFAOYSA-N |