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CAS 20320-46-1

:

2-[(4-Methyl-1-piperazinyl)carbonyl]benzoic acid

Description:
2-[(4-Methyl-1-piperazinyl)carbonyl]benzoic acid, with the CAS number 20320-46-1, is a chemical compound characterized by its structure, which includes a benzoic acid moiety substituted with a piperazine group. This compound typically exhibits properties associated with both aromatic and amine functionalities, contributing to its potential solubility in polar solvents. The presence of the carboxylic acid group suggests it can participate in acid-base reactions, while the piperazine ring may impart basic characteristics and influence its biological activity. The methyl group on the piperazine enhances steric effects and may affect the compound's interaction with biological targets. This compound is of interest in medicinal chemistry, particularly for its potential pharmacological applications, including its role as a building block in drug design. Its stability, reactivity, and interaction with biological systems can be influenced by factors such as pH and temperature, making it a subject of study in various chemical and pharmaceutical contexts.
Formula:C13H16N2O3
InChI:InChI=1S/C13H16N2O3/c1-14-6-8-15(9-7-14)12(16)10-4-2-3-5-11(10)13(17)18/h2-5H,6-9H2,1H3,(H,17,18)
InChI key:InChIKey=ZAFOSGZICIJIGO-UHFFFAOYSA-N
SMILES:C(=O)(C1=C(C(O)=O)C=CC=C1)N2CCN(C)CC2
Synonyms:
  • 2-(4-Methylpiperazin-4-ium-1-carbonyl)benzoate
  • 2-(4-Methylpiperazine-1-carbonyl)benzoic acid
  • 2-[(4-Methyl-1-piperazinyl)carbonyl]benzoic acid
  • Benzoic Acid, 2-[(4-Methyl-1-Piperazinyl)Carbonyl]-
  • Benzoic acid, o-[(4-methyl-1-piperazinyl)carbonyl]-
  • NSC 175229
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