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CAS 522624-51-7

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4-[[(2,3-Dimethylphenyl)amino]sulfonyl]benzoic acid

Description:
4-[[(2,3-Dimethylphenyl)amino]sulfonyl]benzoic acid, identified by its CAS number 522624-51-7, is an organic compound characterized by its sulfonamide functional group and carboxylic acid moiety. This compound features a benzoic acid core substituted with a sulfonamide group, which is linked to a 2,3-dimethylphenyl amine. The presence of the sulfonyl group contributes to its potential as a pharmacophore in medicinal chemistry, often enhancing solubility and bioactivity. The dimethyl substitutions on the phenyl ring can influence the compound's steric and electronic properties, potentially affecting its interactions with biological targets. This compound may exhibit properties such as moderate to high solubility in polar solvents, and its acidic nature suggests it can participate in acid-base reactions. Additionally, due to its structural features, it may have applications in drug development, particularly in the design of inhibitors or modulators in various biochemical pathways. As with many sulfonamides, it may also possess antibacterial properties, although specific biological activities would require empirical investigation.
Formula:C15H15NO4S
InChI:InChI=1S/C15H15NO4S/c1-10-4-3-5-14(11(10)2)16-21(19,20)13-8-6-12(7-9-13)15(17)18/h3-9,16H,1-2H3,(H,17,18)
InChI key:InChIKey=UMBQCIPJSTZQSQ-UHFFFAOYSA-N
SMILES:N(S(=O)(=O)C1=CC=C(C(O)=O)C=C1)C2=C(C)C(C)=CC=C2
Synonyms:
  • 4-[[(2,3-Dimethylphenyl)amino]sulfonyl]benzoic acid
  • Benzoic acid, 4-[[(2,3-dimethylphenyl)amino]sulfonyl]-
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