ethyl 4-(4-chlorophenyl)-6-{[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-chlorophenyl)-6-{[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(4-chlorophenyl)-6-{[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V019-9756 |
| Compound Name: | ethyl 4-(4-chlorophenyl)-6-{[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl}-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 501.03 |
| Molecular Formula: | C26 H33 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccc(cc2)[Cl])NC(N(CC=C)C=1CN1CCN(CC1)C(C1CCC1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8943 |
| logD: | 2.1367 |
| logSw: | -3.7192 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.715 |
| InChI Key: | DXEAWSSHORHBLY-QHCPKHFHSA-N |