HRID1673757

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID5284359

未命名化合物

结构：CCCc1nc(C)n(-c2ccc(OC(C)C)cc2)c(=O)c1Cc1ccc(-c2ccccc2-c2noc(=O)[nH]2)cc1.[Na]

HCID136353187

未命名化合物

PRODUCTS

生成物

结构：CCCc1nc(C)n(-c2ccc(OC(C)C)cc2)c(=O)c1Cc1ccc(-c2ccccc2-c2noc(=O)[nH]2)cc1

HCID135845010

未命名化合物

收率 74.5%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID962

Water

H2O

PROCEDURE

实验过程

To a solution of 3-(4-isopropoxyphenyl)-2-methyl-5-{[2′-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl}-6-propylpyrimidin-4(3H)-one sodium salt (0.56 g) in water (2.0 mL) was added calcium chloride (0.056 g), and the mixture was stirred at room temperature for 1 hr. The resulting solid was collected by filtration to give the title compound (0.40 g, 71%) as a colorless solid.

WORKUP

后处理

filtrationThe resulting solid was collected by filtration

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-cbbeb85ff4694874b6e897f071c1f522
来源数据集: uspto-grants-2011_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07998968B2

反应 SMILES

[Na].[CH:2]([O:5][C:6]1[CH:11]=[CH:10][C:9]([N:12]2[C:17](=[O:18])[C:16]([CH2:19][C:20]3[CH:25]=[CH:24][C:23]([C:26]4[CH:31]=[CH:30][CH:29]=[CH:28][C:27]=4[C:32]4[NH:36][C:35](=[O:37])[O:34][N:33]=4)=[CH:22][CH:21]=3)=[C:15]([CH2:38][CH2:39][CH3:40])[N:14]=[C:13]2[CH3:41])=[CH:8][CH:7]=1)([CH3:4])[CH3:3].[Cl-].[Ca+2].[Cl-]>O>[CH:2]([O:5][C:6]1[CH:11]=[CH:10][C:9]([N:12]2[C:17](=[O:18])[C:16]([CH2:19][C:20]3[CH:25]=[CH:24][C:23]([C:26]4[CH:31]=[CH:30][CH:29]=[CH:28][C:27]=4[C:32]4[NH:36][C:35](=[O:37])[O:34][N:33]=4)=[CH:22][CH:21]=3)=[C:15]([CH2:38][CH2:39][CH3:40])[N:14]=[C:13]2[CH3:41])=[CH:8][CH:7]=1)([CH3:4])[CH3:3]