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CS-W001157 4
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1-Cyclopropyl-1H-imidazole-4-carboxylic acid

  • CAS No. 1368466-66-3

  • Cat. No. CS-0527854
  • Molecule weight152.15
  • Purity≥98%
  • MDL No.None

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

1-Cyclopropyl-1H-imidazole-4-carboxylic acid|CS-0527854

Structure of 1368466-66-3

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General Information

  • CAS No. 1368466-66-3
  • Cat. No. CS-0527854
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈N₂O₂
  • Molecular Weight 152.15
  • Synonym(s) None
  • SMILES O=C(C1=CN(C2CC2)C=N1)O

Description

1-Cyclopropyl-1H-imidazole-4-carboxylic acid features a cyclopropyl group attached to the imidazole ring, enhancing lipophilicity and metabolic stability. This scaffold integrates readily into bioactive molecules, offering a rigid, electron-rich platform for medicinal chemistry applications. The carboxylic acid moiety enables direct conjugation or salt formation, facilitating solubility tuning and downstream derivatization in drug discovery workflows.

Application

1-Cyclopropyl-1H-imidazole-4-carboxylic acid serves as a versatile building block in medicinal chemistry, enabling the synthesis of imidazole-based scaffolds with enhanced metabolic stability. Its carboxylic acid functionality facilitates direct coupling reactions and derivatization under standard amide bond formation conditions. The cyclopropyl substituent imparts favorable lipophilic character and conformational rigidity, contributing to improved target binding affinity. Bench-stable and readily purified by recrystallization, it functions reliably in high-throughput screening campaigns and API intermediate development.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   55.12
  • LogP   0.9162
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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