HRID1291419

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID78607

1,4′-Bipiperidine

C10H20N2

结构：Cn1c(=O)c2c(ncn2Cc2ccc(C(=O)c3ccc(Cl)nc3)cc2)n(C)c1=O

HCID18918845

未命名化合物

PRODUCTS

生成物

结构：Cn1c(=O)c2c(ncn2Cc2ccc(C(=O)c3ccc(N4CCC(N5CCCCC5)CC4)nc3)cc2)n(C)c1=O

HCID18919025

未命名化合物

收率 41.7%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID962

Water

H2O

溶剂HCID1049

Pyridine

C5H5N

PROCEDURE

实验过程

A solution of 7-[4-(6-chloronicotinoyl)benzyl]-1,3-dimethylxanthine (196 mg) and 4-piperidinopiperidine (102 mg) in pyridine (10 ml) was stirred at 60° C. for 5 hours. This reaction mixture was poured in water and extracted with ethyl acetate. The extract was washed with water, dried and concentrated. The residue was purified by silica gel column chromatography (ethyl acetate: acetone: triethylamine 1:1:0.1) to provide the title compound (108 mg).

WORKUP

后处理

extractionextracted with ethyl acetate
washThe extract was washed with water
customdried
concentrationconcentrated
customThe residue was purified by silica gel column chromatography (ethyl acetate: acetone: triethylamine 1:1:0.1)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-86f3f315b9044a4db53fbcd9e1a2322b
来源数据集: uspto-grants-1998_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05753664
来源说明: uspto-grants-1998_05

反应 SMILES

Cl[C:2]1[CH:29]=[CH:28][C:5]([C:6]([C:8]2[CH:27]=[CH:26][C:11]([CH2:12][N:13]3[C:21]4[C:20](=[O:22])[N:19]([CH3:23])[C:18](=[O:24])[N:17]([CH3:25])[C:16]=4[N:15]=[CH:14]3)=[CH:10][CH:9]=2)=[O:7])=[CH:4][N:3]=1.[N:30]1([CH:36]2[CH2:41][CH2:40][NH:39][CH2:38][CH2:37]2)[CH2:35][CH2:34][CH2:33][CH2:32][CH2:31]1>N1C=CC=CC=1.O>[CH3:23][N:19]1[C:20](=[O:22])[C:21]2[N:13]([CH2:12][C:11]3[CH:26]=[CH:27][C:8]([C:6](=[O:7])[C:5]4[CH:28]=[CH:29][C:2]([N:39]5[CH2:40][CH2:41][CH:36]([N:30]6[CH2:35][CH2:34][CH2:33][CH2:32][CH2:31]6)[CH2:37][CH2:38]5)=[N:3][CH:4]=4)=[CH:9][CH:10]=3)[CH:14]=[N:15][C:16]=2[N:17]([CH3:25])[C:18]1=[O:24]