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CS-W001157 4
Total: USD 88.00

4-((2,4-Dichloro-5-methoxyphenyl)amino)-7-fluoro-6-methoxyquinoline-3-carbonitrile

  • CAS No. 622369-46-4

  • Cat. No. CS-0569538
  • Molecule weight392.21
  • Purity≥98%
  • MDL No.None

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

4-((2,4-Dichloro-5-methoxyphenyl)amino)-7-fluoro-6-methoxyquinoline-3-carbonitrile|CS-0569538

Structure of 622369-46-4

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General Information

  • CAS No. 622369-46-4
  • Cat. No. CS-0569538
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₂Cl₂FN₃O₂
  • Molecular Weight 392.21
  • Synonym(s) 4-[(2,4-dichloro-5-methoxyphenyl)amino]-7-fluoro-6-methoxyquinoline-3-carbonitrile
  • SMILES COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=C(C=C3Cl)Cl)OC)F

Synthesis

  • Route1
    • 2,4-Dichloro-5-methoxyaniline Bosutinib  Impurity|CS-0228873
      98446-49-2
    • 4-Chloro-7-fluoro-6-methoxyquinoline-3-carbonitrile|CS-0001088
      622369-40-8
    • ~68%
    • 4-((2,4-Dichloro-5-methoxyphenyl)amino)-7-fluoro-6-methoxyquinoline-3-carbonitrile|CS-0569538
      622369-46-4

    References

    • Boschelli, Diane H.; Wang, Yanong D.; Johnson, Steve; Wu, Biqi; Ye, Fei; Barrios Sosa, Ana Carolina; Golas, Jennifer M.; Boschelli, Frank Journal of Medicinal Chemistry, 2004 , vol. 47, # 7 p. 1599 - 1601
  • Route2
    • null|null
      846023-47-0
    • ~55%
    • 4-((2,4-Dichloro-5-methoxyphenyl)amino)-7-fluoro-6-methoxyquinoline-3-carbonitrile|CS-0569538
      622369-46-4

    References

    • Wyeth Holdings Corporation Patent: US2005/43537 A1, 2005 ; Location in patent: Page/Page column 11 ;
  • Route3

    References

    • Boschelli, Diane H.; Wang, Yanong D.; Johnson, Steve; Wu, Biqi; Ye, Fei; Barrios Sosa, Ana Carolina; Golas, Jennifer M.; Boschelli, Frank Journal of Medicinal Chemistry, 2004 , vol. 47, # 7 p. 1599 - 1601

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   67.17
  • LogP   5.31318
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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