HRID878111

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2734321

[1-(tert-Butoxycarbonyl)-1H-pyrrol-2-yl]boronic acid

C9H14BNO4

结构：Cc1ccccc1-c1cc(Cl)ncc1N(C)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID60197100

未命名化合物

PRODUCTS

生成物

结构：Cc1ccccc1-c1cc(-c2cccn2C(=O)OC(C)(C)C)ncc1N(C)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

HCID86670735

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID21899848

未命名化合物

PROCEDURE

实验过程

The title compound was prepared in analogy to example 72, from N-(6-chloro-4-o-tolyl-pyridin-3-yl)-N-methyl-3,5-bis-trifluoromethyl-benzamide (example 12) and 1-(tert-butoxycarbonyl)pyrrole-2-boronic acid (CAS RN 135884-31-0) and using a gradient of n-heptane:EtOAc (100:0 to 50:50) for the chromatographic purification. Light yellow oil (18%). MS (ESI): m/z=604.202 [M+H]+.

WORKUP

后处理

customfor the chromatographic purification

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c9472cdd3c1142208b533be441899643
来源数据集: uspto-grants-2015_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08987307B2
来源说明: uspto-grants-2015_03

反应 SMILES

Cl[C:2]1[N:7]=[CH:6][C:5]([N:8]([CH3:25])[C:9](=[O:24])[C:10]2[CH:15]=[C:14]([C:16]([F:19])([F:18])[F:17])[CH:13]=[C:12]([C:20]([F:23])([F:22])[F:21])[CH:11]=2)=[C:4]([C:26]2[CH:31]=[CH:30][CH:29]=[CH:28][C:27]=2[CH3:32])[CH:3]=1.[C:33]([O:37][C:38]([N:40]1[CH:44]=[CH:43][CH:42]=[C:41]1B(O)O)=[O:39])([CH3:36])([CH3:35])[CH3:34]>CCCCCCC.CCOC(C)=O>[C:33]([O:37][C:38]([N:40]1[CH:44]=[CH:43][CH:42]=[C:41]1[C:2]1[CH:3]=[C:4]([C:26]2[CH:31]=[CH:30][CH:29]=[CH:28][C:27]=2[CH3:32])[C:5]([N:8]([C:9](=[O:24])[C:10]2[CH:15]=[C:14]([C:16]([F:18])([F:17])[F:19])[CH:13]=[C:12]([C:20]([F:22])([F:23])[F:21])[CH:11]=2)[CH3:25])=[CH:6][N:7]=1)=[O:39])([CH3:36])([CH3:34])[CH3:35]