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CS-W001157 4
Total: USD 88.00

Ethyl 4-(3-benzoylthioureido)benzoate

  • CAS No. 69165-46-4

  • Cat. No. CS-0366302
  • Purity≥98%
  • MDL No.None

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

Ethyl 4-(3-benzoylthioureido)benzoate|CS-0366302

Structure of 69165-46-4

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General Information

  • CAS No. 69165-46-4
  • Cat. No. CS-0366302
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₆N₂O₃S
  • Molecular Weight 328.39
  • Synonym(s) Ethyl 4-(benzoylcarbamothioylamino)benzoate
  • SMILES CCOC(C1=CC=C(NC(NC(C2=CC=CC=C2)=O)=S)C=C1)=O

Synthesis

  • Route1

    References

    • Shearer, Barry G.; Lee, Shuliang; Oplinger, Jeffrey A.; Frick, Lloyd W.; Garvey, Edward P.; Furfine, Eric S. Journal of Medicinal Chemistry, 1997 , vol. 40, # 12 p. 1901 - 1905
  • Route2

    References

    • Saeed, Aamer; Khan, Muhammad Siraj; Rafique, Hummera; Shahid, Mohammad; Iqbal, Jamshed Bioorganic Chemistry, 2014 , vol. 52, p. 1 - 7
  • Route3
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    • Ethyl 4-(3-benzoylthioureido)benzoate|CS-0366302
      69165-46-4

    References

    • Saeed, Aamer; Khan, Muhammad Siraj; Rafique, Hummera; Shahid, Mohammad; Iqbal, Jamshed Bioorganic Chemistry, 2014 , vol. 52, p. 1 - 7

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS09
Signal Word : Warning
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H302-H410
Precautionary Statements : P264-P270-P273-P330-P391-P501

Quality Control

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Computational Chemistry Data

  • TPSA   67.43
  • LogP   2.9901
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   4

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