di(prop-2-en-1-yl) 4-[3-(3-chloro-4-methoxyphenyl)-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-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
di(prop-2-en-1-yl) 4-[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
| Compound ID: | 4476-4929 |
| Compound Name: | di(prop-2-en-1-yl) 4-[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| Molecular Weight: | 560.05 |
| Molecular Formula: | C31 H30 Cl N3 O5 |
| Smiles: | CC1=C(C(C(=C(C)N1)C(=O)OCC=C)c1cn(c2ccccc2)nc1c1ccc(c(c1)[Cl])OC)C(=O)OCC=C |
| Stereo: | ACHIRAL |
| logP: | 5.5849 |
| logD: | 2.0509 |
| logSw: | -5.9637 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.713 |
| InChI Key: | ZWQYETRVYMUQCM-UHFFFAOYSA-N |