CAS 477713-79-4

5-Amino-1-(2,4-dichlorobenzoyl)-1H-pyrazole-4-carbonitrile

Description:

5-Amino-1-(2,4-dichlorobenzoyl)-1H-pyrazole-4-carbonitrile is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. This compound features an amino group (-NH2) and a carbonitrile group (-C≡N), contributing to its reactivity and potential applications in various fields, including pharmaceuticals and agrochemicals. The presence of a 2,4-dichlorobenzoyl substituent enhances its lipophilicity and may influence its biological activity. The dichlorobenzoyl moiety can also play a role in the compound's interaction with biological targets, potentially affecting its efficacy and selectivity. As a pyrazole derivative, it may exhibit properties such as anti-inflammatory, analgesic, or antimicrobial activities, depending on its specific structure and substituents. The compound's CAS number, 477713-79-4, allows for easy identification and reference in chemical databases. Overall, this compound's unique structural features make it a subject of interest for further research and development in medicinal chemistry.

Formula: C₁₁H₆Cl₂N₄O

InChI: InChI=1S/C11H6Cl2N4O/c12-7-1-2-8(9(13)3-7)11(18)17-10(15)6(4-14)5-16-17/h1-3,5H,15H2

InChI key: InChIKey=JYRAOHQURHPBFU-UHFFFAOYSA-N

SMILES: C(=O)(N1C(N)=C(C#N)C=N1)C2=C(Cl)C=C(Cl)C=C2

Synonyms:

• 5-Amino-1-(2,4-dichlorobenzoyl)-1H-pyrazole-4-carbonitrile
• 1H-Pyrazole-4-carbonitrile, 5-amino-1-(2,4-dichlorobenzoyl)-