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CS-W001157 4
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4,4'-(1H-1,2,4-Triazole-3,5-diyl)dipyridine Topiroxostat Impurity

  • CAS No. 4329-78-6

  • Cat. No. CS-0229353
  • Purity≥98%
  • MDL No.MFCD06297778

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

4,4'-(1H-1,2,4-Triazole-3,5-diyl)dipyridine Topiroxostat  Impurity|CS-0229353

Structure of 4329-78-6

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General Information

  • CAS No. 4329-78-6
  • Cat. No. CS-0229353
  • Purity ≥98%
  • MDL No. MFCD06297778
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₉N₅
  • Molecular Weight 223.24
  • Synonym(s) 4-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)pyridine
  • SMILES N=1N=C(NC1C=2C=CN=CC2)C=3C=CN=CC3

Synthesis

  • Route1

    References

    • Xie, Gang; Li, Bing; Chen, Sanping; Yang, Qi; Wei, Wei; Gao, Shengli Science China Chemistry, 2012 , vol. 55, # 3 p. 443 - 450
  • Route2
    • Topiroxostat Impurity 38|CS-0915434
      445218-61-1
    • ~%
    • 4,4'-(1H-1,2,4-Triazole-3,5-diyl)dipyridine Topiroxostat  Impurity|CS-0229353
      4329-78-6

    References

    • Sato, Takahiro; Ashizawa, Naoki; Matsumoto, Koji; Iwanaga, Takashi; Nakamura, Hiroshi; Inoue, Tsutomu; Nagata, Osamu Bioorganic and Medicinal Chemistry Letters, 2009 , vol. 19, # 21 p. 6225 - 6229
  • Route3

    References

    • Jaschunskii et al. Khimicheskaya Nauka i Promyshlennost, 1957 , vol. 2, p. 658 Chem.Abstr., 1958 , p. 6345

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

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Computational Chemistry Data

  • TPSA   67.35
  • LogP   1.9287
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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