Cas no 474707-58-9 (5-(1H-pyrazol-3-yl)thiophene-2-carbonitrile)

5-(1H-Pyrazol-3-yl)thiophene-2-carbonitrile is a heterocyclic compound featuring a pyrazole-thiophene-carbonitrile scaffold, which is of significant interest in pharmaceutical and agrochemical research. Its unique structure serves as a versatile intermediate for synthesizing biologically active molecules, particularly in the development of kinase inhibitors and other therapeutic agents. The presence of both pyrazole and thiophene moieties enhances its potential for forming diverse interactions, improving binding affinity in target applications. The carbonitrile group further contributes to its reactivity, enabling selective functionalization. This compound is valued for its synthetic flexibility, stability, and relevance in medicinal chemistry for designing novel drug candidates.
5-(1H-pyrazol-3-yl)thiophene-2-carbonitrile structure
474707-58-9 structure
Product Name:5-(1H-pyrazol-3-yl)thiophene-2-carbonitrile
CAS No:474707-58-9
MF:C8H5N3S
MW:175.210399389267
MDL:MFCD06808812
CID:2644832
PubChem ID:55282489
Update Time:2025-05-28

5-(1H-pyrazol-3-yl)thiophene-2-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 5-(1H-pyrazol-3-yl)thiophene-2-carbonitrile
    • F13753
    • 474707-58-9
    • EN300-842982
    • AKOS006343512
    • SCHEMBL5903745
    • MDL： MFCD06808812
    • Inchi： 1S/C8H5N3S/c9-5-6-1-2-8(12-6)7-3-4-10-11-7/h1-4H,(H,10,11)
    • InChI Key： ZZPRDLUZRJIQMB-UHFFFAOYSA-N
    • SMILES： S1C(C#N)=CC=C1C1=CC=NN1

Computed Properties

  • Exact Mass: 175.02041835g/mol
  • Monoisotopic Mass: 175.02041835g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 210
  • 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: 1.6
  • Topological Polar Surface Area: 80.7?2

5-(1H-pyrazol-3-yl)thiophene-2-carbonitrile Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Chemenu
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 474707-58-9 97%
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Enamine
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Enamine
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Enamine
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 $728.0 2023-06-06
Enamine
EN300-842982-2.5g
5-(1H-pyrazol-3-yl)thiophene-2-carbonitrile
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 $1428.0 2023-06-06
Enamine
EN300-842982-5.0g
5-(1H-pyrazol-3-yl)thiophene-2-carbonitrile
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 $2110.0 2023-06-06
Enamine
EN300-842982-10.0g
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