ethyl 4-(4-chlorophenyl)-1-ethyl-6-{[3-methyl-4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-chlorophenyl)-1-ethyl-6-{[3-methyl-4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(4-chlorophenyl)-1-ethyl-6-{[3-methyl-4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V019-3760 |
| Compound Name: | ethyl 4-(4-chlorophenyl)-1-ethyl-6-{[3-methyl-4-(4-methylbenzoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 539.07 |
| Molecular Formula: | C29 H35 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | CCN1C(CN2CCN(C(C)C2)C(c2ccc(C)cc2)=O)=C(C(c2ccc(cc2)[Cl])NC1=O)C(=O)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4593 |
| logD: | 4.0294 |
| logSw: | -4.7212 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.156 |
| InChI Key: | RFCYLBGOFBMUKR-UHFFFAOYSA-N |