CAS 618099-01-7

1-(4-Chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carboxaldehyde

Description:

1-(4-Chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carboxaldehyde is a chemical compound characterized by its complex structure, which includes a pyrazole ring, a chlorophenyl group, and a benzodioxin moiety. This compound typically exhibits properties associated with its functional groups, such as potential reactivity due to the aldehyde functional group, which can participate in various chemical reactions, including condensation and oxidation. The presence of the chlorophenyl group may influence its electronic properties and biological activity, potentially enhancing lipophilicity and modulating interactions with biological targets. Additionally, the benzodioxin structure may contribute to its stability and solubility in organic solvents. This compound is of interest in medicinal chemistry and may have applications in drug development, particularly in the search for new therapeutic agents. Its specific characteristics, such as melting point, solubility, and spectral data, would typically be determined through experimental methods and are essential for understanding its behavior in various chemical contexts.

Formula: C₁₈H₁₃ClN₂O₃

InChI: InChI=1S/C18H13ClN2O3/c19-14-2-4-15(5-3-14)21-10-13(11-22)18(20-21)12-1-6-16-17(9-12)24-8-7-23-16/h1-6,9-11H,7-8H2

InChI key: InChIKey=CSBFNXIMTWXOMD-UHFFFAOYSA-N

SMILES: C(=O)C=1C(=NN(C1)C2=CC=C(Cl)C=C2)C=3C=C4C(=CC3)OCCO4

Synonyms:

• 1H-Pyrazole-4-carboxaldehyde, 1-(4-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-
• 1-(4-Chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carboxaldehyde