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CAS 946387-26-4

:

2-[[(4-Chloro-6-methyl-2-pyrimidinyl)amino]methylene]-5-phenyl-1,3-cyclohexanedione

Description:
2-[[(4-Chloro-6-methyl-2-pyrimidinyl)amino]methylene]-5-phenyl-1,3-cyclohexanedione, with CAS number 946387-26-4, is a synthetic organic compound characterized by its complex structure, which includes a pyrimidine ring and a cyclohexanedione moiety. This compound typically exhibits properties such as moderate solubility in organic solvents and potential reactivity due to the presence of functional groups like the imine and carbonyl groups. Its molecular structure suggests it may participate in various chemical reactions, including nucleophilic additions and condensation reactions. The presence of the chloro and methyl substituents on the pyrimidine ring can influence its biological activity and interaction with other molecules. Compounds of this nature are often studied for their potential pharmaceutical applications, particularly in the development of therapeutic agents. Additionally, the compound's stability, melting point, and spectral properties (such as NMR and IR) would be essential for characterizing its behavior in different environments. Overall, this compound represents a class of molecules with diverse applications in medicinal chemistry and drug design.
Formula:C18H16ClN3O2
InChI:InChI=1S/C18H16ClN3O2/c1-11-7-17(19)22-18(21-11)20-10-14-15(23)8-13(9-16(14)24)12-5-3-2-4-6-12/h2-7,10,13H,8-9H2,1H3,(H,20,21,22)
InChI key:InChIKey=MKQOHNFODQPXIV-UHFFFAOYSA-N
SMILES:O=C1CC(CC(=O)C1=CNC=2N=C(C)C=C(Cl)N2)C3=CC=CC=C3
Synonyms:
  • 1,3-Cyclohexanedione, 2-[[(4-chloro-6-methyl-2-pyrimidinyl)amino]methylene]-5-phenyl-
  • 2-[[(4-Chloro-6-methyl-2-pyrimidinyl)amino]methylene]-5-phenyl-1,3-cyclohexanedione
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