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CAS 784130-66-1

:

4-(4-ethylpiperazin-1-yl)benzoic acid

Description:
4-(4-Ethylpiperazin-1-yl)benzoic acid is an organic compound characterized by its piperazine moiety and a benzoic acid functional group. It features a piperazine ring substituted with an ethyl group at one nitrogen atom, which contributes to its basicity and potential for forming hydrogen bonds. The benzoic acid part of the molecule provides acidity due to the carboxylic acid functional group, which can participate in various chemical reactions, including esterification and amidation. This compound is typically used in pharmaceutical research and development, particularly in the synthesis of biologically active molecules. Its structure suggests potential interactions with biological targets, making it of interest in medicinal chemistry. The presence of both the piperazine and benzoic acid functionalities may enhance its solubility and bioavailability, which are critical factors in drug design. Additionally, the compound's properties, such as melting point, solubility, and stability, would be influenced by its molecular structure and the presence of functional groups.
Formula:C13H18N2O2
InChI:InChI=1/C13H18N2O2/c1-2-14-7-9-15(10-8-14)12-5-3-11(4-6-12)13(16)17/h3-6H,2,7-10H2,1H3,(H,16,17)
SMILES:CCN1CCN(CC1)c1ccc(cc1)C(=O)O
Synonyms:
  • Benzoic acid, 4-(4-ethyl-1-piperazinyl)-
  • T6N Dntj A2 Dr Dvq
  • 4-(4-Ethylpiperazino) Benzoic Acid
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