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CS-W001157 4
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1,3,7-Triazaspiro[4.5]decane-2,4-dione

  • CAS No. 78222-09-0

  • Cat. No. CS-0055732
  • Molecule weight169.18
  • Purity≥97%
  • MDL No.None

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

1,3,7-Triazaspiro[4.5]decane-2,4-dione|CS-0055732

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General Information

  • CAS No. 78222-09-0
  • Cat. No. CS-0055732
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₁N₃O₂
  • Molecular Weight 169.18
  • Synonym(s) 2,4,9-triazaspiro[4.5]decane-1,3-dione hydrochloride
  • SMILES C1CC2(CNC1)C(=O)NC(=O)N2

Description

1,3,7-Triazaspiro[4.5]decane-2,4-dione features a rigid spirocyclic scaffold with three nitrogen atoms positioned for strategic molecular recognition. This configuration imparts enhanced solubility and thermal stability, enabling efficient integration into complex heterocyclic architectures. The diketone functionality supports direct derivatization under mild conditions, streamlining access to functionalized analogs in medicinal chemistry and materials synthesis.

Application

1,3,7-Triazaspiro[4.5]decane-2,4-dione serves as a versatile heterocyclic scaffold in medicinal chemistry, enabling the construction of complex nitrogen-containing ring systems. Its spirocyclic architecture provides rigidity and three strategically positioned nitrogen atoms for derivatization. The molecule exhibits excellent bench stability and facilitates efficient functional group manipulation, making it a practical building block for targeted synthesis of bioactive compounds and API intermediates.

Synthesis

  • Route1
    • null|null
      78222-06-7
    • ~82%
    • In-stock
      1,3,7-Triazaspiro[4.5]decane-2,4-dione|CS-0055732
      78222-09-0

    References

    • Ozdowska, Zofia Polish Journal of Chemistry, 1980 , vol. 54, # 10 p. 2065 - 2068

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
Precautionary Statements : P261-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   70.23
  • LogP   -1.052
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   0

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