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CS-W001157 4
Total: USD 88.00

Octahydropyrrolo[1,2-a]pyrazine

  • CAS No. 5654-83-1

  • Cat. No. CS-0002040
  • Purity≥98%
  • MDL No.MFCD00082600

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

Octahydropyrrolo[1,2-a]pyrazine|CS-0002040

Structure of 5654-83-1

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General Information

  • CAS No. 5654-83-1
  • Cat. No. CS-0002040
  • Purity ≥98%
  • MDL No. MFCD00082600
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₄N₂
  • Molecular Weight 126.20
  • Synonym(s) Octahydro-pyrrolo[1,2-a]pyrazine 2HCl
  • SMILES N1(CCC2)C2CNCC1

Description

Octahydropyrrolo[1,2-a]pyrazine is a saturated heterocyclic scaffold featuring two nitrogen atoms in a fused ring system, offering enhanced solubility and metabolic stability. This rigid, electron-rich framework integrates readily into bioactive molecules, serving as a conformationally constrained core for medicinal chemistry applications.

Application

Octahydropyrrolo[1,2-a]pyrazine serves as a versatile saturated heterocyclic scaffold in medicinal chemistry, offering a rigid, nitrogen-rich core with defined stereochemistry. Its amine functionalities enable straightforward derivatization via alkylation, acylation, and reductive amination, facilitating rapid access to diverse analogs. The compound exhibits excellent bench stability and compatibility with standard purification techniques, making it a practical building block for targeted library synthesis.

Synthesis

  • Route1

    References

    • MEMORY PHARMACEUTICALS CORPORATION Patent: US2008/200471 A1, 2008 ; Location in patent: Page/Page column 37; 37-38 ; US 20080200471 A1
  • Route2
    • null|null
      71257-37-9
    • ~79%
    • In-stock
      Octahydropyrrolo[1,2-a]pyrazine|CS-0002040
      5654-83-1

    References

    • Likhosherstov, A. M.; Peresada, V. P.; Skoldinov, A. P. Pharmaceutical Chemistry Journal, 1993 , vol. 27, # 10 p. 716 - 718 Khimiko-Farmatsevticheskii Zhurnal, 1993 , vol. 27, # 10 p. 46 - 48
  • Route3
    • null|null
      88327-63-3
    • ~40%
    • In-stock
      Octahydropyrrolo[1,2-a]pyrazine|CS-0002040
      5654-83-1

    References

    • Shukla, U. K.; Khanna, J. M.; Sharma, Satyavan; Anand, Nitya; Chatterjee, R. K.; Sen, A. B. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1983 , vol. 22, # 7 p. 664 - 668

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3267
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P264-P271-P280-P301+P330+P331-P304+P340-P363-P501

Quality Control

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Computational Chemistry Data

  • TPSA   15.27
  • LogP   0.054
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   0

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