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CS-W001157 4
Total: USD 88.00

Isopropylpiperazine

  • CAS No. 4318-42-7

  • Cat. No. CS-W013460
  • Purity≥98%
  • MDL No.MFCD00167971

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

Isopropylpiperazine|CS-W013460

Structure of 4318-42-7

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General Information

  • CAS No. 4318-42-7
  • Cat. No. CS-W013460
  • Purity ≥98%
  • MDL No. MFCD00167971
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₆N₂
  • Molecular Weight None
  • Synonym(s) None
  • SMILES CC(N1CCNCC1)C

Description

Isopropylpiperazine features a piperazine core substituted with an isopropyl group, delivering enhanced lipophilicity and steric bulk. This structural motif improves membrane permeability and metabolic stability, making it valuable in medicinal chemistry for optimizing pharmacokinetic profiles. The molecule serves as a key scaffold in bioactive compound design.

Application

Isopropylpiperazine serves as a versatile nitrogen-rich building block in medicinal chemistry, enabling the construction of diverse heterocyclic scaffolds. Its moderate basicity and steric profile facilitate efficient functionalization and incorporation into bioactive molecules. The molecule exhibits excellent bench stability and compatibility with common reaction conditions, supporting broad applicability in coupling reactions, amide formation, and late-stage derivatization.

Synthesis

  • Route1
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    • ~%
    • In-stock
      Isopropylpiperazine|CS-W013460
      4318-42-7

    References

    • Nisshin Flour Milling Co., Ltd. Patent: US5972943 A1, 1999 ;
  • Route2

    References

    • G. D. Searle and Co. Patent: US5461047 A1, 1995 ;
  • Route3

    References

    • Tapia, Ines; Alonso-Cires, Luisa; Lopez-Tudanca, Pedro Luis; Mosquera, Ramon; Labeaga, Luis; Innerarity, Ana; Orjales, Aurelio Journal of Medicinal Chemistry, 1999 , vol. 42, # 15 p. 2870 - 2880

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS06
Signal Word : Danger
UN#: 1992
Class : 3 (6.1)
Packing Group : Ⅲ
Hazard Statements : H226-H311-H315-H319-H335
Precautionary Statements : P210-P233-P240-P241-P242-P243-P261-P264-P271-P280-P302+P352-P304+P340-P361+P364-P362+P364-P370+P378-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   15.27
  • LogP   0.3
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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