diethyl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 4476-4103 |
| Compound Name: | diethyl 4-[3-(3-bromo-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 580.48 |
| Molecular Formula: | C29 H30 Br N3 O5 |
| Smiles: | CCOC(C1C(C(=C(C)NC=1C)C(=O)OCC)c1cn(c2ccccc2)nc1c1ccc(c(c1)[Br])OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8938 |
| logD: | 1.8449 |
| logSw: | -5.4141 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.124 |
| InChI Key: | JGQSJEHCWFXHLD-UHFFFAOYSA-N |