ethyl 4-(4-chlorophenyl)-6-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-chlorophenyl)-6-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(4-chlorophenyl)-6-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | C430-5294 |
| Compound Name: | ethyl 4-(4-chlorophenyl)-6-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 425.91 |
| Molecular Formula: | C23 H24 Cl N3 O3 |
| Smiles: | CCOC(C1C(c2ccc(cc2)[Cl])NC(NC=1CN1CCc2ccccc2C1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7073 |
| logD: | 3.7073 |
| logSw: | -4.5083 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.447 |
| InChI Key: | VPQVCGNSMGMBKM-NRFANRHFSA-N |