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Chemical Structure| 1072084-73-1 Chemical Structure| 1072084-73-1

Structure of 1072084-73-1

Chemical Structure| 1072084-73-1

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Product Details of [ 1072084-73-1 ]

CAS No. :1072084-73-1
Formula : C8H9ClIN3O
M.W : 325.53
SMILES Code : ClC1=NC(I)=NC(N2CCOCC2)=C1
MDL No. :MFCD31556966

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Application In Synthesis of [ 1072084-73-1 ]

* 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 [ 1072084-73-1 ]

[ 1072084-73-1 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 1072084-73-1 ]
  • [ 201150-73-4 ]
  • [ 1072084-80-0 ]
YieldReaction ConditionsOperation in experiment
With sodium t-butanolate;tris-(dibenzylideneacetone)dipalladium(0); 4,5-bis(diphenylphos4,5-bis(diphenylphosphino)-9,9-dimethylxanthenephino)-9,9-dimethylxanthene; In 1,4-dioxane; at 80℃; for 3h; Reference Example 31 5-(4-Chloro-6-morpholin-4-yl-pyrimidin-2-ylamino)-3,4- dihydro-lH-isoquinoline-2-carboxylic acid tert-butyl ester; <n="45"/>A mixture of 4-(6-chloro-2-iodo-pyrimidin-4-yl)-morpholine (326 mg; 1.0 mmol), 5- amino-3,4-dihydro-lH-isoquinoline-2-carboxylic acid tert-buty ester (323 mg; 1.3 mmol), NaOBu' (135 mg; 1.4 mmol), Pd2dba3 (13.7 mg; 0.015 mmol) and Xantphos (28.9 mg; 0.05 mmol) in dioxane (2.5 ml) was stirred under argon at 80 0C for 3 h. The reaction mixture was diluted with water (10 ml) and brine (20 ml) then extracted into CH2Cl2 (2 x 35 ml). The combined organic layers were dried (Na2SO4), concentrated and purified by flash chromatography (60:40 to 70:30 EtO Ac/Petrol) to obtain the title compound as a white solid (114 mg). deltaH (400 MHz, CDCl3) 1.51 (s, 9H), 2.75 (t, J = 6.0, 2H), 3.55-3.58 (m, 4H), 3.69 (t, J = 6.0, 2H), 3.74-3.77 (m, 4H), 4.61 (s, 2H), 6.03 (s, IH), 6.59 (br s, IH), 6.92 (d, J = 8.0, IH), 7.22 (t, J = 8.0, IH), 7.75 (d, J = 8.0, IH).
 

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