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HRID75443

反应详情

EQUATION

反应方程式

HRID 75443 的结构方程式

REACTANTS

反应物

3
结构：CC(C)COC(=O)N1c2ccccc2C=CC1OCC(C)C
HCID100621

2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate

C18H25NO3

结构：CN(C)CCC(=O)O
HCID239828

3-(dimethylamino)propanoic acid

C5H11NO2

结构：CC(C)Nc1nc(Cl)nc(N2CC3CCC(C2)O3)c1N.CN(C)CCC(=O)[O-]
HCID86665898

未命名化合物

PRODUCTS

生成物

1
结构：CC(C)Nc1nc(Cl)nc(N2CC3CCC(C2)O3)c1NC(=O)CCN(C)C
HCID86665900

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

1
结构：CN(C)C=O
溶剂HCID6228

N,N-Dimethylformamide

C3H7NO

PROCEDURE

实验过程

6-(8-Oxa-3-azabicyclo[3.2.1]octan-3-yl)-2-chloro-N4-isopropylpyrimidine-4,5-diamine 3-(dimethylamino)propanoate (48, 0.500 g, 1.68 mmoles) was dissolved in dimethylformamide and 3-dimethylaminopropionic acid (0.310 g, 2.02 mmoles) and isobutyl 2-isobutoxyquinoline-1(2H)-carboxylate (IIDQ, 0.699 mL, 2.35 mmoles) were added. The reaction mixture was allowed to stir at room temperature for 18 hours, concentrated, and purified by silica gel column chromatography (5-10% ethanol in dichloromethane) to provide N-(4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2-chloro-6-(isopropylamino)pyrimidin-5-yl)-3-(dimethylamino)propanamide (49) as a tan solid. Yield: 0.350 g (53%). LCMS (Waters walk-on); 2.43 min., 397.2, M+H.

WORKUP

后处理

  1. concentrationconcentrated
  2. custompurified by silica gel column chromatography (5-10% ethanol in dichloromethane)