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Chemical Structure| 59157-06-1 Chemical Structure| 59157-06-1

Structure of 59157-06-1

Chemical Structure| 59157-06-1

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Product Details of [ 59157-06-1 ]

CAS No. :59157-06-1
Formula : C10H2Cl2N4O4
M.W : 313.05
SMILES Code : O=C(Cl)C1=C(N(C=N1)C2=O)C(N3C2=C(C(Cl)=O)N=C3)=O

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Application In Synthesis of [ 59157-06-1 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 59157-06-1 ]

[ 59157-06-1 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 59157-06-1 ]
  • [ 1791-13-5 ]
  • [ 1217317-70-8 ]
  • 2
  • [ 135908-33-7 ]
  • [ 59157-06-1 ]
  • [ 74-89-5 ]
  • methyl 4-([5-(methylcarbamoyl)-1H-imidazol-4-yl]carbonyl}amino)bicyclo[2.2.2]octane-1-carboxylate [ No CAS ]
YieldReaction ConditionsOperation in experiment
198 mg Methyl 4-aminobicyclo[2.2.2]octane-1 -carboxylate (220 mg, 1 .20 mmol, Gas No 135908-33- 7) and N-ethyl-N-isopropylpropan-2-amine (0.31 ml, 1.8 mmol) were added to a suspensionof 5,1 0-dioxo-5H,1 OH-diimidazo[1 ,5-a:1 ,5-d]pyrazine-1 ,6-dicarbonyl dichloride (188 mg,0.600 mmol) in tetrahydrofuran (8.0 ml) and the mixture was stirred at room temperature.After 6 h, a solution of methanamine (0.60 ml, 1 .2 mmol, 2M solution in tetrahydrofuran) andN-ethyl-N-isopropylpropan-2-amine (0.31 ml, 1 .8 mmol) in tetrahydrofuran (8 ml) was addedand the mixture was stirred over night at room temperature. For work-up, precipitates werefiltered off and washed with tetrahydrofuran. The combined filtrates were concentrated andpurified by flash chromatography (Snap Gartridge, hexanes/ethyl acetate gradient 50 % -> 100% ethyl acetate) to provide the title compound (198 mg).LG-MS (Method 2): R = 0.89 mm; MS (ESIpos) m/z = 335.2 [M+H].1HNMR (400 MHz, DMSO-d6): 6 [ppm] = 13.32-12.85 (m, 1H), 11.42-10.51 (m, 1H), 8.93-8.16 (m, 1H), 7.74 (5, 1H), 3.57 (5, 3H), 2.78 (d, 3H), 2.06-1.90 (m, 6H), 1.89-1.70 (m, 6H).
 

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