HRID133721

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID9237

1,4-Diazabicyclo[2.2.2]octane

C6H12N2

结构：COc1ccc(C2C(CCC(O)c3ccc(F)cc3)C(=O)N2c2ccc(OCc3ccc(CBr)cc3)cc2)cc1

HCID21083167

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C2C(CCC(O)c3ccc(F)cc3)C(=O)N2c2ccc(OCc3ccc(C[N+]45CCN(CC4)CC5)cc3)cc2)cc1.[Br-]

HCID21083163

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID1140

Toluene

C7H8

PROCEDURE

实验过程

Compound (25) and DABCO were dissolved in toluene and reacted analogously to Example IV, giving the product (26) as a colorless solid of molecular weight 716.70 (C39H43BrFN3O4); MS (ESI): 636.3 (MH+).

WORKUP

后处理

customreacted analogously to Example IV

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b3bfa02d929d4a65bd51a30abd576fce
来源数据集: uspto-grants-2008_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07390790B2
来源说明: uspto-grants-2008_06

反应 SMILES

[Br:1][CH2:2][C:3]1[CH:40]=[CH:39][C:6]([CH2:7][O:8][C:9]2[CH:14]=[CH:13][C:12]([N:15]3[CH:18]([C:19]4[CH:24]=[CH:23][C:22]([O:25][CH3:26])=[CH:21][CH:20]=4)[CH:17]([CH2:27][CH2:28][CH:29]([C:31]4[CH:36]=[CH:35][C:34]([F:37])=[CH:33][CH:32]=4)[OH:30])[C:16]3=[O:38])=[CH:11][CH:10]=2)=[CH:5][CH:4]=1.[CH2:41]1[N:46]2[CH2:47][CH2:48][N:43]([CH2:44][CH2:45]2)[CH2:42]1>C1(C)C=CC=CC=1>[Br-:1].[F:37][C:34]1[CH:35]=[CH:36][C:31]([CH:29]([OH:30])[CH2:28][CH2:27][CH:17]2[C:16](=[O:38])[N:15]([C:12]3[CH:13]=[CH:14][C:9]([O:8][CH2:7][C:6]4[CH:39]=[CH:40][C:3]([CH2:2][N+:43]56[CH2:48][CH2:47][N:46]([CH2:45][CH2:44]5)[CH2:41][CH2:42]6)=[CH:4][CH:5]=4)=[CH:10][CH:11]=3)[CH:18]2[C:19]2[CH:24]=[CH:23][C:22]([O:25][CH3:26])=[CH:21][CH:20]=2)=[CH:32][CH:33]=1