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N-((3-fluorophenyl)carbamothioyl)benzamide

  • CAS No. 82635-62-9

  • Cat. No. CS-0523565
  • Purity≥98%
  • MDL No.MFCD01023683

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

N-((3-fluorophenyl)carbamothioyl)benzamide|CS-0523565

Structure of 82635-62-9

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General Information

  • CAS No. 82635-62-9
  • Cat. No. CS-0523565
  • Purity ≥98%
  • MDL No. MFCD01023683
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₁FN₂OS
  • Molecular Weight 274.31
  • Synonym(s) 1-BENZOYL-3-(3-FLUOROPHENYL)THIOUREA
  • SMILES O=C(NC(NC1=CC=CC(F)=C1)=S)C2=CC=CC=C2

Synthesis

  • Route1

    References

    • Rauf, Muhammad Khawar; Talib, Ammara; Badshah, Amin; Zaib, Sumera; Shoaib, Khurram; Shahid, Mohammad; Floerke, Ulrich; Imtiaz-Ud-Din; Iqbal, Jamshed European Journal of Medicinal Chemistry, 2013 , vol. 70, p. 487 - 496
  • Route2
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      98-88-4
    • ~%
    • N-((3-fluorophenyl)carbamothioyl)benzamide|CS-0523565
      82635-62-9

    References

    • Schnur, Rodney C.; Fliri, Anton F. J.; Kajiji, Shama; Pollack, Vincent A. Journal of Medicinal Chemistry, 1991 , vol. 34, # 3 p. 914 - 918
  • Route3

    References

    • Rauf, Muhammad Khawar; Talib, Ammara; Badshah, Amin; Zaib, Sumera; Shoaib, Khurram; Shahid, Mohammad; Floerke, Ulrich; Imtiaz-Ud-Din; Iqbal, Jamshed European Journal of Medicinal Chemistry, 2013 , vol. 70, p. 487 - 496

Safety Information

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

Quality Control

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Computational Chemistry Data

  • TPSA   41.13
  • LogP   2.9525
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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