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CAS 641569-94-0

:

4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid

Description:
4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid, with the CAS number 641569-94-0, is a chemical compound characterized by its complex structure, which includes a benzoic acid moiety substituted with a methyl group and an amino group linked to a pyrimidine and pyridine ring system. This compound typically exhibits properties such as being a solid at room temperature, with potential solubility in polar organic solvents. Its molecular structure suggests it may engage in hydrogen bonding due to the presence of the carboxylic acid group and the amino group, which can influence its reactivity and interactions with biological targets. The presence of heterocyclic rings (pyridine and pyrimidine) may impart specific pharmacological properties, making it of interest in medicinal chemistry. Additionally, the compound may exhibit specific spectral characteristics in techniques such as NMR and IR spectroscopy, aiding in its identification and characterization. Overall, its unique structural features suggest potential applications in pharmaceuticals or as a research chemical.
Formula:C17H14N4O2
InChI:InChI=1/C17H14N4O2/c1-11-4-5-12(16(22)23)9-15(11)21-17-19-8-6-14(20-17)13-3-2-7-18-10-13/h2-10H,1H3,(H,22,23)(H,19,20,21)
SMILES:Cc1ccc(cc1Nc1nccc(c2cccnc2)n1)C(=O)O
Synonyms:
  • 4-Methyl-3-{[4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzoic acid
  • Benzoic acid, 4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-
  • 4-Methyl-3-(4-pyridin-3-yl-pyrimidin-2-ylamino)-benzoic acid
  • 4-Methyl-3-[(4-(3-Pyridinyl)-Pyrimidinyl)Amino]Benzoic Acid
  • 4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidiny]amino]benzoicacid
  • 4-methyl-3-((4-(3-pyridinyl)-2-pyrimidinyl)amino)benzoic acid
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