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5-(4-(tert-Butoxycarbonyl)piperazin-1-yl)pyrazine-2-carboxylic acid

  • CAS No. 1209646-17-2

  • Cat. No. CS-0060950
  • Purity≥97%
  • MDL No.None

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

5-(4-(tert-Butoxycarbonyl)piperazin-1-yl)pyrazine-2-carboxylic acid|CS-0060950

Structure of 1209646-17-2

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General Information

  • CAS No. 1209646-17-2
  • Cat. No. CS-0060950
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₀N₄O₄
  • Molecular Weight 308.33
  • Synonym(s) 5-(4-(tert-Butoxycarbonyl)
  • SMILES CC(C)(C)OC(=O)N1CCN(CC1)C2=CN=C(C=N2)C(=O)O

Description

This pyrazine-based scaffold integrates a tert-butoxycarbonyl-protected piperazine moiety, offering a stable, moisture-tolerant platform for late-stage diversification in medicinal chemistry. The carboxylic acid functionality enables direct conjugation or salt formation, facilitating downstream derivatization in drug discovery workflows.

Application

5-(4-(tert-Butoxycarbonyl)piperazin-1-yl)pyrazine-2-carboxylic acid serves as a versatile building block for constructing bioactive heterocycles in medicinal chemistry. The tert-butoxycarbonyl (Boc) group provides stable protection of the piperazine nitrogen, enabling selective deprotection and derivatization under mild acidic conditions. The pyrazine-2-carboxylic acid moiety offers a rigid, polar scaffold suitable for metal coordination and hydrogen bonding, enhancing target affinity. This compound facilitates efficient synthesis of kinase inhibitors and other pharmaceutical candidates through standard amide coupling and reductive amination protocols.

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   95.86
  • LogP   1.2319
  • H_Acceptors   6
  • H_Donors   1
  • Rotatable_Bonds   2

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