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3-Methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine

  • CAS No. 886886-04-0

  • Cat. No. CS-D1646
  • Purity≥96%
  • MDL No.MFCD09832899

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

3-Methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine|CS-D1646

Structure of 886886-04-0

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General Information

  • CAS No. 886886-04-0
  • Cat. No. CS-D1646
  • Purity ≥96%
  • MDL No. MFCD09832899
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀N₄
  • Molecular Weight 138.17
  • Synonym(s) 5,6,7,8-Tetrahydro-3-methyl-1,2,4-triazolo[4,3-a]pyrazine
  • SMILES CC1=NN=C2CNCCN21

Description

3-Methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine features a fused heterocyclic core with enhanced stability and favorable solubility in polar organic solvents. This scaffold integrates a methyl-substituted triazolopyrazine system, enabling efficient incorporation into medicinal chemistry libraries. The fully saturated ring system supports metabolic resilience and predictable binding interactions in target-directed synthesis.

Application

3-Methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine serves as a versatile heterocyclic building block in medicinal chemistry, enabling efficient construction of nitrogen-rich scaffolds. Its saturated triazolopyrazine core exhibits favorable bench stability and functional group tolerance, facilitating downstream derivatization via standard coupling and substitution reactions. The molecule functions effectively in the synthesis of bioactive compounds, particularly those requiring rigid, polarized heterocyclic frameworks for target engagement.

Synthesis

  • Route1

    References

    • US2008/96877 A1, ; Page/Page column 118-119 ; US 20080096877 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

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Computational Chemistry Data

  • TPSA   42.74
  • LogP   -0.31028
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   0

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