diethyl 1-(3,4-dimethylphenyl)-4-(3-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Chemical Structure Depiction of
diethyl 1-(3,4-dimethylphenyl)-4-(3-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
diethyl 1-(3,4-dimethylphenyl)-4-(3-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Compound characteristics
Compound ID: | K813-0063 |
Compound Name: | diethyl 1-(3,4-dimethylphenyl)-4-(3-fluorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
Molecular Weight: | 423.48 |
Molecular Formula: | C25 H26 F N O4 |
Smiles: | CCOC(C1=CN(C=C(C1c1cccc(c1)F)C(=O)OCC)c1ccc(C)c(C)c1)=O |
Stereo: | ACHIRAL |
logP: | 5.5437 |
logD: | 5.5437 |
logSw: | -5.4266 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 44.156 |
InChI Key: | DSGVJVDJPGGRLI-UHFFFAOYSA-N |