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CS-W001157 4
Total: USD 88.00

4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl)-2-fluoro-N-methylbenzamide Enzalutamide Impurity

  • CAS No. 915087-33-1

  • Cat. No. CS-0166952
  • Purity≥98%
  • MDL No.MFCD14155804

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

4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl)-2-fluoro-N-methylbenzamide  Enzalutamide Impurity|CS-0166952

Structure of 915087-33-1

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General Information

  • CAS No. 915087-33-1
  • Cat. No. CS-0166952
  • Purity ≥98%
  • MDL No. MFCD14155804
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₁H₁₆F₄N₄O₂S
  • Molecular Weight 464.44
  • Synonym(s) 4-[3-[4-Cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-4-oxo-2-thioxo-1-imidazolidinyl]-2-fluoro-N-methylbenzamide;Enzalutamide
  • SMILES O=C(NC)C1=CC=C(N(C(N2C3=CC=C(C#N)C(C(F)(F)F)=C3)=S)C(C)(C)C2=O)C=C1F

Synthesis

  • Route1
    • In-stock
      4-((2-Cyanopropan-2-yl)amino)-2-fluoro-N-methylbenzamide|CS-B0040
      915087-32-0
    • null|null
      143782-23-4
    • ~25%
    • In-stock
      4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl)-2-fluoro-N-methylbenzamide  Enzalutamide Impurity|CS-0166952
      915087-33-1

    References

    • Regents of the University of California Patent: US2007/254933 A1, 2007 ; Location in patent: Page/Page column 7 ;
  • Route2
    • In-stock
      Methyl 2-((3-fluoro-4-(methylcarbamoyl)phenyl)amino)-2-methylpropanoate|CS-M2261
      1332524-01-2
    • null|null
      143782-23-4
    • ~79%
    • In-stock
      4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl)-2-fluoro-N-methylbenzamide  Enzalutamide Impurity|CS-0166952
      915087-33-1

    References

    • MEDIVATION PROSTATE THERAPEUTICS, INC.; JAIN, Rajendra, Parasmal; ANGELAUD, Remy; THOMPSON, Andrew; LAMBERSON, Carol; GREENFIELD, Scott Patent: WO2011/106570 A1, 2011 ; Location in patent: Page/Page column 46 ;
  • Route3
    • null|null
      463-71-8
    • null|null
      1289942-55-7
    • ~4%
    • In-stock
      4-(3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-4-oxo-2-thioxoimidazolidin-1-yl)-2-fluoro-N-methylbenzamide  Enzalutamide Impurity|CS-0166952
      915087-33-1

    References

    • MEDIVATION PROSTATE THERAPEUTICS, INC.; JAIN, Rajendra, Parasmal; ANGELAUD, Remy; THOMPSON, Andrew; LAMBERSON, Carol; GREENFIELD, Scott Patent: WO2011/106570 A1, 2011 ; Location in patent: Page/Page column 48 ;

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 : P264-P270-P280-P302+P352-P330-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   76.44
  • LogP   3.99248
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   3

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