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CS-W001157 4
Total: USD 88.00

6-Chloro-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one

  • CAS No. 6288-99-9

  • Cat. No. CS-0071571
  • Molecule weight246.65
  • Purity≥97%
  • MDL No.MFCD18917258

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

6-Chloro-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one|CS-0071571

Structure of 6288-99-9

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General Information

  • CAS No. 6288-99-9
  • Cat. No. CS-0071571
  • Purity ≥97%
  • MDL No. MFCD18917258
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₇ClN₄O
  • Molecular Weight 246.65
  • Synonym(s) 6-chloro-1-phenyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
  • SMILES O=C1C2=C(N(C3=CC=CC=C3)N=C2)N=C(Cl)N1

Synthesis

  • Route1
    • 4,6-Dichloro-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine|CS-0137588
      99971-84-3
    • ~%
    • 6-Chloro-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one|CS-0071571
      6288-99-9

    References

    • Cheng; Robins Journal of Organic Chemistry, 1958 , vol. 23, p. 852,855 Journal of Organic Chemistry, 1959 , vol. 24, p. 1570
  • Route2
    • null|null
      100-63-0
    • ~%
    • 6-Chloro-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one|CS-0071571
      6288-99-9

    References

    • Meng, Fei; Huang, Manna; Zhu, Xinhai; Wan, Yiqian; Hou, Jing; Shao, Yong-Xian; Cai, Yonghong; Li, Zhe; Xu, Jie; Liu, Peiqing; Luo, Hai-Bin; Ke, Hengming; Wu, Pei-Ying Journal of Medicinal Chemistry, 2012 , vol. 55, # 19 p. 8549 - 8558,10
  • Route3

    References

    • Cheng; Robins Journal of Organic Chemistry, 1958 , vol. 23, p. 852,855 Journal of Organic Chemistry, 1959 , vol. 24, p. 1570

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-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   63.57
  • LogP   1.7622
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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