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CS-W001157 4
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6-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid

  • CAS No. 869941-96-8

  • Cat. No. CS-0080424
  • Purity≥95%
  • MDL No.MFCD05861682

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

6-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid|CS-0080424

Structure of 869941-96-8

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General Information

  • CAS No. 869941-96-8
  • Cat. No. CS-0080424
  • Purity ≥95%
  • MDL No. MFCD05861682
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇N₃O₂
  • Molecular Weight 177.16
  • Synonym(s) Albb-009893
  • SMILES CC(C=N1)=CN2C1=C(C(O)=O)C=N2

Description

6-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid features a fused heterocyclic core with a methyl group at the 6-position and a carboxylic acid function at C3, enabling direct conjugation or derivatization. This scaffold offers enhanced stability and favorable solubility profiles for applications in medicinal chemistry and kinase inhibitor development.

Application

6-Methylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid serves as a versatile heterocyclic building block for medicinal chemistry and materials science applications. Its fused pyrazolo-pyrimidine core provides structural rigidity and enhanced metabolic stability, while the carboxylic acid group enables direct derivatization via amide coupling or esterification. The methyl substituent at the 6-position enhances lipophilicity and modulates electronic properties, facilitating fine-tuning of physicochemical behavior in target-directed synthesis. This compound exhibits good bench stability and is compatible with standard purification techniques.

Synthesis

  • Route1

    References

    • US2012/15962 A1, ; Page/Page column 90 ; US 20120015962 A1

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-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   67.49
  • LogP   0.73592
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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