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CS-W001157 4
Total: USD 88.00

8-Chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyrazine

  • CAS No. 68774-78-7

  • Cat. No. CS-0071363
  • Purity≥98%
  • MDL No.None

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

8-Chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyrazine|CS-0071363

Structure of 68774-78-7

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General Information

  • CAS No. 68774-78-7
  • Cat. No. CS-0071363
  • Purity ≥98%
  • MDL No. None
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₅ClN₄
  • Molecular Weight 168.58
  • Synonym(s) 8-Chloro-3-methyl-1,2,4-triazolo[4,3-a]pyrazine
  • SMILES ClC1=NC=CN2C1=NN=C2C

Description

8-Chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyrazine is a heterocyclic compound featuring a fused triazolopyrazine core with electron-withdrawing chlorine and methyl substituents. This configuration imparts enhanced stability and targeted reactivity, enabling its use in medicinal chemistry scaffolds and as a building block for bioactive molecules. The molecule exhibits favorable solubility profiles under standard conditions, facilitating integration into synthetic workflows.

Application

8-Chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyrazine serves as a versatile heterocyclic building block in medicinal chemistry, enabling the construction of bioactive scaffolds through nucleophilic substitution and transition-metal-catalyzed coupling reactions. Its stability under standard reaction conditions, combined with orthogonal reactivity at the chloro and methyl positions, facilitates efficient functionalization for drug discovery applications.

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   43.08
  • LogP   1.08612
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   0

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