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tert-Butyl 3-amino-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxylate

  • CAS No. 398491-64-0

  • Cat. No. CS-0048329
  • Purity≥98%
  • MDL No.None

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

tert-Butyl 3-amino-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxylate|CS-0048329

Structure of 398491-64-0

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General Information

  • CAS No. 398491-64-0
  • Cat. No. CS-0048329
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₈N₄O₂
  • Molecular Weight 238.29
  • Synonym(s) tert-Butyl 3-amino-6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5(4H)-carboxylate
  • SMILES CC(C)(C)OC(=O)N1CCC2=C(C1)C(N)=NN2

Description

tert-Butyl 3-amino-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxylate is a bench-stable, moisture-tolerant heterocyclic building block featuring a strategically positioned amino group and tert-butyl ester. This scaffold integrates readily into medicinal chemistry campaigns targeting kinase inhibitors and CNS-active compounds, offering enhanced solubility and metabolic stability in synthetic sequences.

Application

tert-Butyl 3-amino-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxylate serves as a versatile building block for pyrazolopyridine-based scaffolds, enabling efficient access to medicinally relevant heterocycles. The protected amine and ester functionalities offer orthogonal reactivity, facilitating downstream derivatization via coupling, reduction, or cyclization. Its bench-stable nature and compatibility with standard synthetic protocols make it well-suited for iterative synthesis in medicinal chemistry and process development workflows.

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

Quality Control

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Computational Chemistry Data

  • TPSA   84.24
  • LogP   1.2851
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   0

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