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N-(6-Chloropyridazin-3-yl)-2-(3-(trifluoromethoxy)phenyl)acetamide

  • CAS No. 1439400-46-0

  • Cat. No. CS-0012096
  • Purity≥97%
  • MDL No.None

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

N-(6-Chloropyridazin-3-yl)-2-(3-(trifluoromethoxy)phenyl)acetamide|CS-0012096

Structure of 1439400-46-0

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General Information

  • CAS No. 1439400-46-0
  • Cat. No. CS-0012096
  • Purity ≥97%
  • MDL No. None
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉ClF₃N₃O₂
  • Molecular Weight 331.68
  • Synonym(s) N-(6-Chloro-3-pyridazinyl)-2-[3-(trifluoromethoxy)phenyl]acetamide
  • SMILES ClC1=NN=C(NC(CC2=CC=CC(OC(F)(F)F)=C2)=O)C=C1

Description

N-(6-Chloropyridazin-3-yl)-2-(3-(trifluoromethoxy)phenyl)acetamide features a trifluoromethoxy-substituted phenyl ring paired with a chloropyridazinyl amide, delivering enhanced electron-withdrawing character and metabolic stability. This scaffold integrates readily into kinase inhibitor scaffolds and other bioactive molecules requiring halogenated heterocyclic motifs.

Application

N-(6-Chloropyridazin-3-yl)-2-(3-(trifluoromethoxy)phenyl)acetamide serves as a versatile building block in medicinal chemistry, enabling efficient construction of heterocyclic scaffolds via nucleophilic substitution and cross-coupling reactions. The 6-chloropyridazinyl moiety provides a reactive handle for further functionalization, while the trifluoromethoxy-substituted aryl group enhances metabolic stability and modulates lipophilicity. Bench-stable and compatible with standard purification protocols, it facilitates streamlined synthesis of kinase inhibitors and other bioactive compounds.

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-P280-P302+P352

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Computational Chemistry Data

  • TPSA   64.11
  • LogP   3.2098
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   4

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