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CAS 354994-01-7

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4-[(4,6-dimethylpyrimidin-2-yl)carbamimidamido]benzoic acid

Description:
4-[(4,6-Dimethylpyrimidin-2-yl)carbamimidamido]benzoic acid, with the CAS number 354994-01-7, is a chemical compound characterized by its complex structure, which includes a benzoic acid moiety and a pyrimidine ring. This compound features a carbamimidamido functional group, which contributes to its potential as a bioactive molecule. The presence of the dimethyl groups on the pyrimidine ring enhances its lipophilicity and may influence its interaction with biological targets. Typically, compounds like this may exhibit properties such as antimicrobial or antitumor activity, although specific biological activities would depend on further empirical studies. The molecular structure suggests that it could participate in hydrogen bonding due to the carboxylic acid and amine functionalities, which may affect its solubility and reactivity. Additionally, the compound's stability and behavior in various environments would be influenced by factors such as pH and temperature. Overall, this compound represents a class of organic molecules that may have significant implications in medicinal chemistry and drug development.
Formula:C14H15N5O2
InChI:InChI=1/C14H15N5O2/c1-8-7-9(2)17-14(16-8)19-13(15)18-11-5-3-10(4-6-11)12(20)21/h3-7H,1-2H3,(H,20,21)(H3,15,16,17,18,19)
SMILES:Cc1cc(C)nc(n1)NC(=N)Nc1ccc(cc1)C(=O)O
Synonyms:
  • 4-[N'-(4,6-Dimethylpyrimidin-2-yl)carbamimidamido]benzoic acid
  • Benzoic acid, 4-[[[(4,6-dimethyl-2-pyrimidinyl)amino]iminomethyl]amino]-
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