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CS-W001157 4
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tert-Butyl 3-(piperazin-1-yl)azetidine-1-carboxylate

  • CAS No. 178311-48-3

  • Cat. No. CS-0020809
  • Purity≥95%
  • MDL No.MFCD09264407

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

tert-Butyl 3-(piperazin-1-yl)azetidine-1-carboxylate|CS-0020809

Structure of 178311-48-3

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General Information

  • CAS No. 178311-48-3
  • Cat. No. CS-0020809
  • Purity ≥95%
  • MDL No. MFCD09264407
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₃N₃O₂
  • Molecular Weight 241.34
  • Synonym(s) None
  • SMILES O=C(OC(C)(C)C)N1CC(N2CCNCC2)C1

Description

tert-Butyl 3-(piperazin-1-yl)azetidine-1-carboxylate features a strained azetidine core fused to a piperazine ring, delivering enhanced metabolic stability and improved solubility in polar solvents. This scaffold integrates readily into bioactive molecules, serving as a key building block for kinase inhibitors and CNS-targeted therapeutics.

Application

tert-Butyl 3-(piperazin-1-yl)azetidine-1-carboxylate serves as a versatile building block in medicinal chemistry, enabling the efficient construction of azetidine-containing scaffolds. The piperazinyl group provides enhanced solubility and hydrogen-bonding capacity, while the tert-butyl ester offers bench stability and convenient deprotection under mild acidic conditions. It functions effectively in standard coupling reactions and facilitates the incorporation of rigid, bioactive azetidine motifs into drug candidates.

Safety Information

Download SDS
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   44.81
  • LogP   0.5109
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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