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CS-W001157 4
Total: USD 88.00

Enzalutamide impurity 4

  • CAS No. 1802242-47-2

  • Cat. No. CS-0163835
  • Purity≥98%
  • MDL No.None

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

Enzalutamide impurity 4|CS-0163835

Structure of 1802242-47-2

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General Information

  • CAS No. 1802242-47-2
  • Cat. No. CS-0163835
  • Purity ≥98%
  • MDL No. None
  • Storage -20°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₆FNO₄
  • Molecular Weight 269.27
  • Synonym(s) None
  • SMILES O=C(OC)C1=CC=C(NC(C)(C)C(OC)=O)C=C1F

Description

Methyl 2-fluoro-4-((1-methoxy-2-methyl-1-oxopropan-2-yl)amino)benzoate is a key impurity associated with enzalutamide synthesis, characterized by its fluorinated aromatic core and methoxy-substituted amide functionality. This structurally defined compound features a stable ester group and a hindered tertiary amide linkage, enabling precise analytical tracking during pharmaceutical process development.

Application

Methyl 2-fluoro-4-((1-methoxy-2-methyl-1-oxopropan-2-yl)amino)benzoate serves as a key synthetic intermediate in the production of enzalutamide, functioning as a building block for the core aryl amine moiety. Its stability under standard reaction conditions and compatibility with amide coupling protocols facilitate efficient integration into pharmaceutical synthesis workflows. The molecule enables precise construction of the trifluoromethyl-substituted aromatic scaffold found in next-generation anti-androgen therapeutics.

Safety Information

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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-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   64.63
  • LogP   1.9758
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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