structure of 4-Chloro-2-(1-methyl-1,4-dihydropyridin-4-ylidene)-3-oxobutanenitrile

4-Chloro-2-(1-methyl-1,4-dihydropyridin-4-ylidene)-3-oxobutanenitrile

CAS No.: 1000932-32-0
M. Wt: 208.64
M. Fa: C10H9ClN2O
InChI Key: GDYOGYFCFARNPF-UHFFFAOYSA-N

Names and Identifiers of 1000932-32-0

CAS Number

1000932-32-0

IUPAC Name

4-chloro-2-(1-methylpyridin-4-ylidene)-3-oxobutanenitrile

InChI

InChI=1S/C10H9ClN2O/c1-13-4-2-8(3-5-13)9(7-12)10(14)6-11/h2-5H,6H2,1H3

InChIKey

GDYOGYFCFARNPF-UHFFFAOYSA-N

Canonical SMILES

CN1C=CC(=C(C#N)C(=O)CCl)C=C1

Physical and chemical properties of 1000932-32-0

Molecular Formula

C10H9ClN2O

Molecular Weight

208.64

Applications of 1000932-32-0

This compound has several applications:

  • Pharmaceuticals: Due to its biological activity, it is explored as a potential drug candidate for various diseases.
  • Agricultural Chemicals: Its derivatives may be utilized in agrochemicals for pest control due to their antimicrobial properties.
  • Chemical Intermediates: It serves as an intermediate in the synthesis of more complex organic molecules.

Interaction Studies of 1000932-32-0

Studies focusing on the interactions of 4-Chloro-2-(1-methyl-1,4-dihydropyridin-4-ylidene)-3-oxobutanenitrile with biological macromolecules are essential:

  • Protein Binding Studies: Understanding how this compound interacts with proteins can provide insights into its mechanism of action.
  • Receptor Interaction: Investigating its binding affinity to various receptors can help elucidate its therapeutic potential.

Biological Activity of 1000932-32-0

Research indicates that 4-Chloro-2-(1-methyl-1,4-dihydropyridin-4-ylidene)-3-oxobutanenitrile exhibits significant biological activities. Its derivatives have shown:

  • Antioxidant Properties: The compound is noted for its antioxidative capabilities, which are crucial for mitigating oxidative stress in biological systems.
  • Antimicrobial Activity: Preliminary studies suggest potential antimicrobial properties against various pathogens.
  • Enzyme Inhibition: It may act as an inhibitor for certain enzymes, contributing to its therapeutic potential.