HRID1971236

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1ccc(CNc2nc3ccc(-c4cnc5ccccc5c4)cc3c3c2n(C)c(=O)n3-c2ccc(C(C)(C)C#N)cc2)cc1

HCID53630357

未命名化合物

PRODUCTS

生成物

结构：Cn1c(=O)n(-c2ccc(C(C)(C)C#N)cc2)c2c3cc(-c4cnc5ccccc5c4)ccc3nc(N)c21

HCID11979156

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6422

未命名化合物

PROCEDURE

实验过程

110 mg (0.182 mmol) of 2-{4-[4-(4-methoxy-benzylamino)-3-methyl-2-oxo-8-quinolin-3-yl-2,3-dihydro-imidazo[4,5-c]quinolin-1-yl]-phenyl}-2-methyl-propionitrile (Example 109a) in 1.1 ml TFA are stirred at rt for 24 h and then at 35° C. for 5 h. The reaction mixture is purified by preparative HPLC to provide the title compound as an off-white solid. ES-MS: 485 (M+H)+; analytical HPLC: tret=2.86 minutes (Grad 1).

WORKUP

后处理

customThe reaction mixture is purified by preparative HPLC

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ad3071e7f97346a6a1a6c9afef286274
来源数据集: uspto-grants-2013_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08431592B2
来源说明: uspto-grants-2013_04

反应 SMILES

COC1C=CC(C[NH:8][C:9]2[C:18]3[N:19]([CH3:34])[C:20](=[O:33])[N:21]([C:22]4[CH:27]=[CH:26][C:25]([C:28]([CH3:32])([CH3:31])[C:29]#[N:30])=[CH:24][CH:23]=4)[C:17]=3[C:16]3[CH:15]=[C:14]([C:35]4[CH:36]=[N:37][C:38]5[C:43]([CH:44]=4)=[CH:42][CH:41]=[CH:40][CH:39]=5)[CH:13]=[CH:12][C:11]=3[N:10]=2)=CC=1>C(O)(C(F)(F)F)=O>[NH2:8][C:9]1[C:18]2[N:19]([CH3:34])[C:20](=[O:33])[N:21]([C:22]3[CH:27]=[CH:26][C:25]([C:28]([CH3:32])([CH3:31])[C:29]#[N:30])=[CH:24][CH:23]=3)[C:17]=2[C:16]2[CH:15]=[C:14]([C:35]3[CH:36]=[N:37][C:38]4[C:43]([CH:44]=3)=[CH:42][CH:41]=[CH:40][CH:39]=4)[CH:13]=[CH:12][C:11]=2[N:10]=1