CAS 1033463-20-5

5-Chloro-1-[(2-chloro-6-fluorophenyl)methyl]-1,6-dihydro-6-oxo-3-pyridinecarboxaldehyde

Description:

5-Chloro-1-[(2-chloro-6-fluorophenyl)methyl]-1,6-dihydro-6-oxo-3-pyridinecarboxaldehyde is a chemical compound characterized by its complex structure, which includes a pyridine ring and multiple halogen substituents. This compound features a chloro group and a fluorine atom, which can influence its reactivity and biological activity. The presence of the aldehyde functional group suggests potential for reactivity in condensation reactions or as a precursor in synthetic pathways. Its dihydro-6-oxo structure indicates that it may exhibit keto-enol tautomerism, which can affect its stability and reactivity. The compound's molecular interactions may be influenced by the electron-withdrawing effects of the halogens, potentially enhancing its lipophilicity and altering its pharmacokinetic properties. Given its structural complexity, this compound may have applications in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific biological pathways. However, detailed studies would be necessary to fully understand its properties, including solubility, stability, and biological activity.

Formula: C₁₃H₈Cl₂FNO₂

InChI: InChI=1S/C13H8Cl2FNO2/c14-10-2-1-3-12(16)9(10)6-17-5-8(7-18)4-11(15)13(17)19/h1-5,7H,6H2

InChI key: InChIKey=MBJKIJDANCOFLM-UHFFFAOYSA-N

SMILES: C(C1=C(Cl)C=CC=C1F)N2C=C(C=O)C=C(Cl)C2=O

Synonyms:

• 3-Pyridinecarboxaldehyde, 5-chloro-1-[(2-chloro-6-fluorophenyl)methyl]-1,6-dihydro-6-oxo-
• 5-Chloro-1-[(2-chloro-6-fluorophenyl)methyl]-1,6-dihydro-6-oxo-3-pyridinecarboxaldehyde