97393-57-2 Usage
Molecular structure
1-Phenyl-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxylic acid has a complex molecular structure, which includes a cyclohepta[c]pyrazole ring with a phenyl group attached and a carboxylic acid group at the 3-position.
Derivative of pyrazole
1-phenyl-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxylic acid is a derivative of pyrazole, a heterocyclic organic compound that contains a five-membered ring with two nitrogen atoms.
Contains a phenyl group
The compound has a phenyl group (a carbon-based ring structure with delocalized electrons) attached to the cyclohepta[c]pyrazole ring, which may contribute to its potential applications in medicinal chemistry.
Carboxylic acid group
The presence of a carboxylic acid group (-COOH) at the 3-position of the cyclohepta[c]pyrazole ring indicates that 1-phenyl-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxylic acid may be used as a building block for drug synthesis, as carboxylic acids are commonly found in pharmaceuticals.
Potential applications in medicinal chemistry
Due to the presence of a carboxylic acid group and the unique structure of the compound, 1-phenyl-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-3-carboxylic acid may have potential applications in the field of medicinal chemistry, possibly as a precursor for drug synthesis or as a pharmacophore.
Research interest
The compound's unique structure and properties may make it of interest for research into the properties and reactivity of heterocyclic compounds, which could lead to the development of new synthetic methods or the discovery of novel chemical reactions.
Check Digit Verification of cas no
The CAS Registry Mumber 97393-57-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,7,3,9 and 3 respectively; the second part has 2 digits, 5 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 97393-57:
(7*9)+(6*7)+(5*3)+(4*9)+(3*3)+(2*5)+(1*7)=182
182 % 10 = 2
So 97393-57-2 is a valid CAS Registry Number.
97393-57-2Relevant academic research and scientific papers
Cui, Jialin,Cui, Li,Dong, Yawen,Guo, Bingbo,Jiang, Biaobiao,Yang, Qing,Yang, Xinling,Zhang, Li
, (2020)
Insect growth regulators (IGRs), which can interrupt or inhibit pest life cycles, are low-toxicity pesticides widely used in integrated pest management (IPM). Ecdysone analogues and chitinase inhibitors are familiar IGRs that have attracted considerable attention because of their unique modes of action and low toxicity to non-target organisms. To find new and highly effective candidate IGRs with novel mechanisms, D-08 (N-(4-(tert-butyl)phenyl)-2-phenyl-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-5-carboxamide) was chosen as a lead compound, and a series of novel heptacyclic pyrazolamide derivatives were designed and synthesized using the scaffold hopping strategy. The bioassay showed that III-27 (N-(2-methylphenethyl)-1-phenyl-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole-5-carboxamide) had excellent activity against Plutella xylostella. Protein verification and molecular docking indicated that III-27 could act on both the ecdysone receptor (EcR) and Ostrinia furnacalis chitinase (Of ChtI) and is a promising new lead IGRs. The interaction mechanism of III-27 with EcR and Of ChtI was then studied by molecular docking. These results provide important guidance for the study of new dual-target IGRs.
