HRID1497773

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6323

Methyl bromide

CH3Br

2 次

结构：Cc1c(-c2ccnn2-c2ccc(C#N)cc2)cn2nc(NC(=O)CN(C)C)nc2c1-c1cccc(C(F)(F)F)c1

HCID73051428

未命名化合物

PRODUCTS

生成物

结构：Cc1c(-c2ccnn2-c2ccc(C#N)cc2)cn2nc(NC(=O)C[N+](C)(C)C)nc2c1-c1cccc(C(F)(F)F)c1.[Br-]

HCID73051429

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6342

Acetonitrile

C2H3N

PROCEDURE

实验过程

N-[6-[2-(4-Cyano-phenyl)-2H-pyrazol-3-yl]-7-methyl-8-(3-trifluoromethyl-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-2-dimethylamino-acetamide (Ex. 14, 10 mg, 0.018 mmol) was stirred in MeCN (0.5 mL) and a solution of MeBr (ca. 30% in MeCN, 0.01 mL) added, followed after 15 mins by a further MeBr solution (0.05 mL). The reaction mixture was stirred for 18 hrs before being concentrated in vacuo to give title compound as an off-white solid (11 mg).

WORKUP

后处理

concentrationbefore being concentrated in vacuo

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-31b547a4576a4ec5a8b5f099e947fd14
来源数据集: uspto-grants-2015_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09199984B2
来源说明: uspto-grants-2015_12

反应 SMILES

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