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CS-W001157 4
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5-Pyridin-4-yl-1H-1,2,4-triazol-3-amine

  • CAS No. 3652-17-3

  • Cat. No. CS-0035695
  • Purity≥98%
  • MDL No.MFCD00465601

*For research and further manufacturing use only, not for direct human use.

5-Pyridin-4-yl-1H-1,2,4-triazol-3-amine|CS-0035695

Structure of 3652-17-3

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General Information

  • CAS No. 3652-17-3
  • Cat. No. CS-0035695
  • Purity ≥98%
  • MDL No. MFCD00465601
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇N₅
  • Molecular Weight 161.17
  • Synonym(s) 5-(Pyridin-4-yl)-4H-1,2,4-triazol-3-amine
  • SMILES N=1N=C(NC1N)C=2C=CN=CC2

Description

5-Pyridin-4-yl-1H-1,2,4-triazol-3-amine integrates a pyridyl moiety with a triazolamine core, delivering a versatile scaffold for metal coordination and hydrogen bonding. This bench-stable compound features enhanced solubility in polar solvents and serves as a key building block in ligand design for catalytic systems and functional materials.

Application

5-Pyridin-4-yl-1H-1,2,4-triazol-3-amine serves as a versatile heterocyclic building block in medicinal chemistry, enabling the construction of bioactive scaffolds through standard coupling and functionalization reactions. Its pyridyl and triazolyl moieties offer complementary reactivity for transition metal-catalyzed transformations and hydrogen bonding interactions in target binding. The compound exhibits bench stability, facilitates purification by standard chromatographic methods, and functions effectively in both small-molecule synthesis and high-throughput screening campaigns.

Synthesis

  • Route1
    • Isonicotinic acid Nicotinic Acid  Impurity|CS-0229405
      55-22-1
    • null|null
      2834-84-6
    • ~89%
    • In-stock
      5-Pyridin-4-yl-1H-1,2,4-triazol-3-amine|CS-0035695
      3652-17-3

    References

    • Lipinski, Christopher A. Journal of Medicinal Chemistry, 1983 , vol. 26, # 1 p. 1 - 6
  • Route2
    • Isoniazid Topiroxostat  Impurity|CS-0229354
      54-85-3
    • ~%
    • In-stock
      5-Pyridin-4-yl-1H-1,2,4-triazol-3-amine|CS-0035695
      3652-17-3

    References

    • Journal of Medicinal Chemistry, , vol. 28, # 11 p. 1628 - 1636
  • Route3
    • null|null
      1354647-05-4
    • ~%
    • In-stock
      5-Pyridin-4-yl-1H-1,2,4-triazol-3-amine|CS-0035695
      3652-17-3

    References

    • Chernyshev; Tarasova; Chernysheva; Taranushich Russian Journal of Applied Chemistry, 2011 , vol. 84, # 11 p. 1890 - 1896

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   80.48
  • LogP   0.4489
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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