di(prop-2-en-1-yl) 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
di(prop-2-en-1-yl) 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
di(prop-2-en-1-yl) 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 4476-4930 |
| Compound Name: | di(prop-2-en-1-yl) 4-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 574.47 |
| Molecular Formula: | C30 H28 Br N3 O4 |
| Smiles: | CC1=C(C(C(=C(C)N1)C(=O)OCC=C)c1cn(c2ccccc2)nc1c1ccc(cc1)[Br])C(=O)OCC=C |
| Stereo: | ACHIRAL |
| logP: | 6.0119 |
| logD: | 2.4779 |
| logSw: | -5.5937 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.082 |
| InChI Key: | QSNHXQMLDAFBAE-UHFFFAOYSA-N |