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

  • CAS No. 1414958-47-6

  • Cat. No. CS-0146371
  • Purity≥98%
  • MDL No.MFCD22689368

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

3-Bromo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine hydrobromide|CS-0146371

Structure of 1414958-47-6

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General Information

  • CAS No. 1414958-47-6
  • Cat. No. CS-0146371
  • Purity ≥98%
  • MDL No. MFCD22689368
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₈Br₂N₄
  • Molecular Weight 283.95
  • Synonym(s) 3-BROMO-5,6,7,8-TETRAHYDRO-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE HBR
  • SMILES BrC1=NN=C2CNCCN21.[H]Br

Description

This tetrahydrotriazolopyrazine derivative features a brominated heterocyclic core with enhanced solubility in polar solvents, enabling straightforward integration into synthetic sequences. The hydrobromide salt form ensures stability and ease of handling under standard laboratory conditions.

Application

3-Bromo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine hydrobromide serves as a versatile heterocyclic building block for medicinal chemistry and process development. The bromo-substituted tetrahydropyrazine core enables palladium-catalyzed cross-coupling reactions with broad functional group tolerance. Its bench-stable, crystalline form facilitates straightforward handling and purification, making it well-suited for modular synthesis of complex nitrogen-containing scaffolds in API discovery.

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   42.74
  • LogP   0.7217
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   0

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