diethyl 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 4476-1658 |
| Compound Name: | diethyl 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 550.45 |
| Molecular Formula: | C28 H28 Br N3 O4 |
| Smiles: | CCOC(C1C(C(=C(C)NC=1C)C(=O)OCC)c1cn(c2ccccc2)nc1c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.0031 |
| logD: | 1.9543 |
| logSw: | -5.525 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.494 |
| InChI Key: | IZAFKSYWKVIRTA-UHFFFAOYSA-N |