propan-2-yl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
propan-2-yl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
propan-2-yl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 4678-1589 |
| Compound Name: | propan-2-yl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 525.4 |
| Molecular Formula: | C25 H25 Br N4 O4 |
| Smiles: | CC(C)OC(C1C(c2cn(c3ccccc3)nc2c2ccc(c(c2)[Br])OC)NC(NC=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3531 |
| logD: | 4.2246 |
| logSw: | -4.2882 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.387 |
| InChI Key: | KJJTUPJZCTZNDA-QHCPKHFHSA-N |