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CAS 175203-47-1

:

1,2,3,4-Tetrahydro-1-(1-methylethyl)-2,4-dioxo-3-(phenylmethyl)-5-pyrimidinecarbonitrile

Description:
1,2,3,4-Tetrahydro-1-(1-methylethyl)-2,4-dioxo-3-(phenylmethyl)-5-pyrimidinecarbonitrile is a chemical compound characterized by its complex structure, which includes a pyrimidine ring and multiple functional groups. The presence of dioxo groups indicates that it has two carbonyl functionalities, contributing to its reactivity and potential biological activity. The compound also features a phenylmethyl group, which can enhance lipophilicity and influence its interaction with biological targets. The carbonitrile group adds to its polar character, potentially affecting solubility and reactivity. This compound may exhibit pharmacological properties, making it of interest in medicinal chemistry. Its molecular structure suggests potential applications in drug development, particularly in targeting specific biological pathways. The compound's synthesis and characterization would typically involve standard organic chemistry techniques, and its stability and reactivity would be influenced by the electronic effects of the substituents on the pyrimidine ring. Overall, this compound represents a unique scaffold that could be explored for various chemical and biological applications.
Formula:C15H15N3O2
InChI:InChI=1S/C15H15N3O2/c1-11(2)17-10-13(8-16)14(19)18(15(17)20)9-12-6-4-3-5-7-12/h3-7,10-11H,9H2,1-2H3
InChI key:InChIKey=CGYSBPLTCJYBOI-UHFFFAOYSA-N
SMILES:C(N1C(=O)N(C(C)C)C=C(C#N)C1=O)C2=CC=CC=C2
Synonyms:
  • 1,2,3,4-Tetrahydro-1-(1-methylethyl)-2,4-dioxo-3-(phenylmethyl)-5-pyrimidinecarbonitrile
  • 3-Benzyl-1-(1-Methylethyl)-2,4-Dioxo-1,2,3,4-Tetrahydropyrimidine-5-Carbonitrile
  • 5-Pyrimidinecarbonitrile, 1,2,3,4-tetrahydro-1-(1-methylethyl)-2,4-dioxo-3-(phenylmethyl)-
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