Cas no 1352926-13-6 (2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide)

2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide is a versatile organic compound with significant applications in pharmaceutical research. It features a pyrazole core with a bromo and methyl substituent, enhancing its reactivity and bioactivity. This compound offers a high degree of structural specificity, making it ideal for the development of novel therapeutic agents. Its unique structural features contribute to its potential in inhibiting various enzymes, which is crucial in drug discovery processes.
2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide structure
1352926-13-6 structure
Product Name:2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide
CAS No:1352926-13-6
MF:C12H12BrN3O
MW:294.147181510925
MDL:MFCD19443345
CID:1016105
PubChem ID:70700742
Update Time:2025-06-20

2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide Chemical and Physical Properties

Names and Identifiers

    • 1-Benzyl-4-bromo-3-methyl-1H-pyrazole-5-carboxamide
    • AK-89946
    • ANW-67129
    • CTK8C1723
    • KB-218076
    • 2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide
    • CEC92613
    • 2-benzyl-4-bromo-5-methylpyrazole-3-carboxamide
    • DTXSID70743538
    • CS-0445119
    • 1352926-13-6
    • 1-Benzyl-4-bromo-3-methyl-1H-pyrazole-5-carboxamide, 99%
    • AMY26008
    • AKOS016006465
    • AS-41284
    • MDL: MFCD19443345
    • Inchi: 1S/C12H12BrN3O/c1-8-10(13)11(12(14)17)16(15-8)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H2,14,17)
    • InChI Key: SWGUCROCDBPHGE-UHFFFAOYSA-N
    • SMILES: BrC1C(C)=NN(C=1C(N)=O)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 293.01637g/mol
  • Monoisotopic Mass: 293.01637g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 281
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 60.9?2

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2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide Related Literature

Additional information on 2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide

Professional Introduction to 2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide (CAS No. 1352926-13-6)

2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide (CAS No. 1352926-13-6) is a specialized organic compound that has garnered significant attention in the field of pharmaceutical and chemical research. This compound, characterized by its unique structural features, exhibits promising potential in various biological and chemical applications. The presence of a benzyl group, bromine substituent, and methyl group on the pyrazole core imparts distinct chemical properties that make it a valuable candidate for further investigation.

The molecular structure of 2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide consists of a pyrazole ring system, which is a heterocyclic compound containing nitrogen atoms at positions 1 and 4 of the ring. This structural motif is well-known for its versatility in medicinal chemistry due to its ability to interact with biological targets. The benzyl group at position 2, the bromine atom at position 4, and the methyl group at position 5 contribute to the compound's overall reactivity and functionality. These substituents not only influence the electronic properties of the molecule but also play a crucial role in determining its biological activity.

In recent years, there has been a growing interest in exploring the pharmacological properties of pyrazole derivatives. The< strong>2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide has been studied for its potential as an intermediate in the synthesis of various pharmacologically active compounds. Its structural framework allows for modifications that can enhance binding affinity to specific biological targets, making it a valuable scaffold for drug discovery.

One of the most compelling aspects of 2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide is its role in developing novel therapeutic agents. Researchers have utilized this compound as a building block to create molecules with anti-inflammatory, antimicrobial, and anticancer properties. The bromine substituent, in particular, has been shown to enhance the bioavailability and metabolic stability of derived compounds, making them more suitable for clinical applications.

The< strong>pyrazole core of this compound is particularly noteworthy due to its extensive biological activity. Pyrazoles have been extensively studied for their ability to modulate various enzymatic pathways and receptor interactions. The< strong>brominated pyrazole derivatives, such as 2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide, have shown promise in preclinical studies as inhibitors of kinases and other critical targets involved in disease pathways.

The synthesis of< strong>2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide involves multi-step organic reactions that require precise control over reaction conditions. The introduction of the benzyl group, bromine atom, and methyl group necessitates careful selection of reagents and catalysts to ensure high yield and purity. Advances in synthetic methodologies have enabled more efficient production processes, making this compound more accessible for research purposes.

In addition to its pharmaceutical applications, 2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide has found utility in materials science and chemical research. Its unique electronic properties make it a candidate for developing new materials with specific optical or electronic characteristics. The< strong>brominated aromatic compounds, including this derivative, are particularly interesting due to their potential use in organic electronics and photovoltaic devices.

The< strong>molecular diversity offered by< strong>2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide allows researchers to explore a wide range of biological activities. By modifying different parts of the molecule, scientists can fine-tune its interactions with biological targets, leading to the discovery of new drugs with improved efficacy and reduced side effects. This flexibility makes it an indispensable tool in drug discovery programs.

The< strong>CAS No. 1352926-13-6 provides a unique identifier for this compound, ensuring accurate documentation and tracking in research settings. This standardized numbering system is essential for maintaining consistency across scientific literature and databases, facilitating collaboration among researchers worldwide.

In conclusion, 2-benzyl-4-bromo-5-methyl-pyrazole-3-carboxamide (CAS No. 1352926-13-6) is a multifaceted compound with significant potential in pharmaceuticals and chemical research. Its unique structural features make it a valuable scaffold for developing novel therapeutic agents, while its diverse applications extend into materials science. As research continues to uncover new uses for this compound, it is likely to remain a cornerstone of innovation in both academic and industrial settings.

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