HRID1386998

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID13174868

4-[2-(Pyrrolidin-1-yl)ethoxy]benzoic acid--hydrogen chloride (1/1)

C13H18ClNO3

HCID21182907

未命名化合物

PRODUCTS

生成物

结构：O=C(O)C(=O)O.O=C(O)C(=O)O.O=C(c1ccc(OCCN2CCCC2)cc1)c1c(-c2ccc(OCCN3CCCC3)nc2)sc2ccccc12

HCID86757082

未命名化合物

收率 30%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6212

Chloroform

CHCl3

PROCEDURE

实验过程

By essentially following the procedure detailed in Example 1, Part C, the title compound was prepared from 5-(benzo[b]thiophen-2-yl)pyrid-2-yl 2-(1-pyrrolidinyl)ethyl ether (Part B) and 4-[2-(1-pyrrolidinyl)ethoxy]benzoic acid hydrochloride in 30% yield as a solid following flash chromatography (SiO2; 5% MeOH in CHCl3) The free base was converted to the dioxalate salt according to the conditions outlined in Example 1, Part C.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f7c6834203724248a5c0b690a468b0dc
来源数据集: uspto-grants-2001_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06265575B1
来源说明: uspto-grants-2001_07

反应 SMILES

[N:1]1([CH2:6][CH2:7][O:8][C:9]2[CH:14]=[CH:13][C:12]([C:15]3[S:19][C:18]4[CH:20]=[CH:21][CH:22]=[CH:23][C:17]=4[CH:16]=3)=[CH:11][N:10]=2)[CH2:5][CH2:4][CH2:3][CH2:2]1.Cl.[N:25]1([CH2:30][CH2:31][O:32][C:33]2[CH:41]=[CH:40][C:36]([C:37]([OH:39])=[O:38])=[CH:35][CH:34]=2)[CH2:29][CH2:28][CH2:27][CH2:26]1.[CH3:42][OH:43]>C(Cl)(Cl)Cl>[C:37]([OH:39])(=[O:38])[C:42]([OH:8])=[O:43].[C:37]([OH:39])(=[O:38])[C:42]([OH:8])=[O:43].[N:1]1([CH2:6][CH2:7][O:8][C:9]2[N:10]=[CH:11][C:12]([C:15]3[S:19][C:18]4[CH:20]=[CH:21][CH:22]=[CH:23][C:17]=4[C:16]=3[C:37]([C:36]3[CH:35]=[CH:34][C:33]([O:32][CH2:31][CH2:30][N:25]4[CH2:29][CH2:28][CH2:27][CH2:26]4)=[CH:41][CH:40]=3)=[O:38])=[CH:13][CH:14]=2)[CH2:5][CH2:4][CH2:3][CH2:2]1