CAS 866137-46-4

1,2,3,4,5,6-Hexahydro-1,3-dimethyl-2,4,5-trioxofuro[2,3-d]pyrimidine-6-carboxaldehyde 6-[O-[(2,4-dichlorophenyl)methyl]oxime]

Description:

1,2,3,4,5,6-Hexahydro-1,3-dimethyl-2,4,5-trioxofuro[2,3-d]pyrimidine-6-carboxaldehyde 6-[O-[(2,4-dichlorophenyl)methyl]oxime] is a complex organic compound characterized by its unique structural features, including a fused pyrimidine and furo[2,3-d] ring system. This compound contains multiple functional groups, such as aldehyde and oxime, which contribute to its reactivity and potential applications in medicinal chemistry. The presence of the dichlorophenyl moiety suggests possible interactions with biological targets, making it of interest in drug development. Its hexahydro structure indicates saturation, which may influence its physical properties, such as solubility and stability. The compound's molecular architecture suggests potential for diverse chemical reactivity, including nucleophilic addition and condensation reactions. As with many complex organic molecules, its synthesis and characterization would require careful analytical techniques, such as NMR and mass spectrometry, to confirm its identity and purity. Overall, this compound exemplifies the intricate nature of synthetic organic chemistry and its relevance in pharmaceutical research.

Formula: C₁₆H₁₃Cl₂N₃O₅

InChI: InChI=1S/C16H13Cl2N3O5/c1-20-14(23)12-13(22)11(26-15(12)21(2)16(20)24)6-19-25-7-8-3-4-9(17)5-10(8)18/h3-6,11H,7H2,1-2H3

InChI key: InChIKey=SYBKLWHLMMBUGO-UHFFFAOYSA-N

SMILES: CN1C2=C(C(=O)C(C=NOCC3=C(Cl)C=C(Cl)C=C3)O2)C(=O)N(C)C1=O

Synonyms:

• Furo[2,3-d]pyrimidine-6-carboxaldehyde, 1,2,3,4,5,6-hexahydro-1,3-dimethyl-2,4,5-trioxo-, 6-[O-[(2,4-dichlorophenyl)methyl]oxime]
• 1,2,3,4,5,6-Hexahydro-1,3-dimethyl-2,4,5-trioxofuro[2,3-d]pyrimidine-6-carboxaldehyde 6-[O-[(2,4-dichlorophenyl)methyl]oxime]