Cas no 40535-14-6 (5-methyl-1H-pyrazole-3-carbohydrazide)

5-Methyl-1H-pyrazole-3-carbohydrazide is a versatile heterocyclic compound featuring a pyrazole core substituted with a methyl group at the 5-position and a carbohydrazide moiety at the 3-position. This structure imparts significant reactivity, making it a valuable intermediate in organic synthesis and medicinal chemistry. The carbohydrazide functional group enhances its chelating properties, enabling applications in coordination chemistry and catalyst design. Its pyrazole scaffold is known for bioactivity, contributing to potential pharmacological uses, such as antimicrobial or anti-inflammatory agents. The compound’s stability and synthetic accessibility further support its utility in developing novel derivatives for drug discovery and material science. Its well-defined structure allows for precise modifications, facilitating targeted research applications.
5-methyl-1H-pyrazole-3-carbohydrazide structure
40535-14-6 structure
Product Name:5-methyl-1H-pyrazole-3-carbohydrazide
CAS No:40535-14-6
MF:C5H8N4O
MW:140.143219947815
MDL:MFCD03423274
CID:328005
PubChem ID:737234
Update Time:2025-07-02

5-methyl-1H-pyrazole-3-carbohydrazide Chemical and Physical Properties

Names and Identifiers

    • 5-Methyl-1H-pyrazole-3-carbohydrazide
    • 1H-Pyrazole-3-carboxylicacid, 5-methyl-, hydrazide
    • 3-METHYL-1H-PYRAZOLE-5-CARBOHYDRAZIDE
    • 5-Methyl-1H-pyrazole-3-carboxylic acid hydrazide
    • 5-Methyl-2H-pyrazole-3-carboxylic acid hydrazide
    • 5-methylpyrazole-3-carbohydrazide
    • MLS000769004
    • ARONIS001214
    • HMS2780M08
    • STK071111
    • SBB021111
    • BBL012753
    • NE12451
    • SMR000433738
    • AB000322
    • SY064054
    • 40535-14-6
    • J-517729
    • W15798
    • 5-methyl-1 h-pyrazole-3-carboxylic acid hydrazide
    • 3-Methyl-1H-pyrazole-5-carboxylic acid hydrazide
    • SCHEMBL16027471
    • Z56812747
    • AT10954
    • CHEMBL1610192
    • EN300-110839
    • MFCD03423274
    • 5-Methyl-1H-pyrazole-3-carbohydrazide, AldrichCPR
    • CS-0153140
    • SCHEMBL2824535
    • AKOS025394992
    • A6780
    • DTXSID40353209
    • 7Y-0813
    • AKOS000264904
    • AS-8023
    • SB86067
    • BB 0219208
    • FT-0616036
    • AKOS000305723
    • 5-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACIDHYDRAZIDE
    • DB-026356
    • 1H-pyrazole-5-carboxylic acid, 3-methyl-, hydrazide
    • ALBB-016329
    • 5-methyl-2H-pyrazole-3-carbohydrazide
    • 5-methyl-1H-pyrazole-3-carbohydrazide
    • MDL: MFCD03423274
    • Inchi: 1S/C5H8N4O/c1-3-2-4(9-8-3)5(10)7-6/h2H,6H2,1H3,(H,7,10)(H,8,9)
    • InChI Key: FWNHUZOBVQZERU-UHFFFAOYSA-N
    • SMILES: O=C(C1C=C(C)NN=1)NN

Computed Properties

  • Exact Mass: 140.07000
  • Monoisotopic Mass: 140.07
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 138
  • 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
  • Surface Charge: 0
  • Tautomer Count: 11
  • XLogP3: -0.5
  • Topological Polar Surface Area: 83.8

Experimental Properties

  • Color/Form: No data available
  • Density: 1.337
  • Melting Point: 156-158°C
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • Refractive Index: 1.605
  • PSA: 83.80000
  • LogP: 0.41280

5-methyl-1H-pyrazole-3-carbohydrazide Security Information

5-methyl-1H-pyrazole-3-carbohydrazide Customs Data

  • HS CODE:2933199090
  • Customs Data:

    China Customs Code:

    2933199090

    Overview:

    2933199090. Other structurally non fused pyrazole ring compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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5-methyl-1H-pyrazole-3-carbohydrazide Related Literature

Additional information on 5-methyl-1H-pyrazole-3-carbohydrazide

Recent Advances in the Research of 5-methyl-1H-pyrazole-3-carbohydrazide (CAS: 40535-14-6)

5-methyl-1H-pyrazole-3-carbohydrazide (CAS: 40535-14-6) is a heterocyclic compound that has garnered significant attention in the field of chemical biology and pharmaceutical research due to its versatile pharmacological properties. Recent studies have explored its potential as a key scaffold in the development of novel therapeutic agents, particularly in the areas of antimicrobial, anticancer, and anti-inflammatory applications. This research brief aims to synthesize the latest findings on this compound, highlighting its molecular mechanisms, synthetic pathways, and therapeutic potential.

One of the most notable advancements in the study of 5-methyl-1H-pyrazole-3-carbohydrazide is its role as a precursor in the synthesis of biologically active derivatives. A 2023 study published in the Journal of Medicinal Chemistry demonstrated that modifications to the carbohydrazide moiety could enhance its binding affinity to specific enzyme targets, such as cyclooxygenase-2 (COX-2) and histone deacetylases (HDACs). These modifications have shown promise in reducing inflammatory responses and inhibiting cancer cell proliferation, respectively. The study also reported a novel synthetic route for 5-methyl-1H-pyrazole-3-carbohydrazide derivatives, which improved yield and purity compared to traditional methods.

In the context of antimicrobial research, 5-methyl-1H-pyrazole-3-carbohydrazide has exhibited potent activity against a range of bacterial and fungal pathogens. A recent Antimicrobial Agents and Chemotherapy article highlighted its efficacy against methicillin-resistant Staphylococcus aureus (MRSA) and Candida albicans. The compound's mechanism of action involves disrupting cell wall synthesis and inhibiting key metabolic enzymes, making it a promising candidate for overcoming antibiotic resistance. Furthermore, computational docking studies have identified specific interactions between the compound and microbial proteins, providing a foundation for future structure-activity relationship (SAR) studies.

Another area of interest is the compound's potential in neurodegenerative disease research. Preliminary in vitro studies have suggested that 5-methyl-1H-pyrazole-3-carbohydrazide derivatives can modulate oxidative stress pathways and reduce neuronal apoptosis. A 2024 preprint on bioRxiv reported that these derivatives could cross the blood-brain barrier and exhibit neuroprotective effects in models of Alzheimer's disease. While these findings are promising, further in vivo studies are needed to validate their therapeutic potential.

Despite these advancements, challenges remain in the clinical translation of 5-methyl-1H-pyrazole-3-carbohydrazide-based therapies. Issues such as pharmacokinetic stability, bioavailability, and potential off-target effects need to be addressed. Recent efforts have focused on optimizing the compound's physicochemical properties through structural modifications and formulation strategies. For instance, a 2023 patent application disclosed a nanoparticle-based delivery system designed to enhance the compound's solubility and targeted delivery.

In conclusion, 5-methyl-1H-pyrazole-3-carbohydrazide (CAS: 40535-14-6) represents a versatile and promising scaffold in drug discovery. Its applications span antimicrobial, anticancer, and neuroprotective therapies, supported by a growing body of preclinical evidence. Future research should prioritize translational studies to bridge the gap between laboratory findings and clinical applications. Collaborative efforts between chemists, biologists, and pharmacologists will be essential to unlock the full potential of this compound.

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