di(prop-2-en-1-yl) 4-[3-(4-ethoxy-3-nitrophenyl)-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-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
di(prop-2-en-1-yl) 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 4476-4924 |
| Compound Name: | di(prop-2-en-1-yl) 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 584.63 |
| Molecular Formula: | C32 H32 N4 O7 |
| Smiles: | CCOc1ccc(cc1[N+]([O-])=O)c1c(cn(c2ccccc2)n1)C1C(=C(C)NC(C)=C1C(=O)OCC=C)C(=O)OCC=C |
| Stereo: | ACHIRAL |
| logP: | 5.2264 |
| logD: | 1.6924 |
| logSw: | -5.074 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.373 |
| InChI Key: | HXMKGCVUAJZIFD-UHFFFAOYSA-N |