3,3-dimethylbutan-2-yl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
3,3-dimethylbutan-2-yl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
3,3-dimethylbutan-2-yl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8008-5082 |
| Compound Name: | 3,3-dimethylbutan-2-yl 4-(4-chlorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 350.84 |
| Molecular Formula: | C18 H23 Cl N2 O3 |
| Smiles: | CC(C(C)(C)C)OC(C1C(c2ccc(cc2)[Cl])NC(NC=1C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8769 |
| logD: | 3.7267 |
| logSw: | -4.5525 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.111 |
| InChI Key: | NXMVPKJCXSMFSL-UHFFFAOYSA-N |