HRID1748682

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID8471

Triethylamine

C6H15N

HCID62325

2-Methylpropanoyl chloride

C4H7ClO

结构：Cc1cc(NC(=O)c2cnn(-c3ccc(C(F)(F)F)cn3)c2C)cnc1C1CCNCC1

HCID86692544

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(NC(=O)c2cnn(-c3ccc(C(F)(F)F)cn3)c2C)cnc1C1CCN(C(=O)C(C)C)CC1

HCID86692630

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID702

Ethanol

C2H6O

溶剂HCID962

Water

H2O

CONDITIONS

反应条件

温度: 40 °C

PROCEDURE

实验过程

2-Methylpropanoylchloride (79 μl) was added to a mixture of 5-methyl-N-[5-methyl-6-(piperidin-4-yl)pyridin-3-yl]-1-[5-(trifluoromethyl)pyridin-2-yl]-1H-pyrazole-4-carboxamide (222 mg) described in Reference Example 171 and pyridine (2.5 ml), and stirred at 40° C. for five hours. Triethylamine (350 μl), water and ethanol were added to the reaction solution, and the precipitated solid was washed with water to give the titled compound (220 mg) as a white solid.

WORKUP

后处理

washthe precipitated solid was washed with water

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c7ad1d0cd07a4315a5626b736fd3f7cb
来源数据集: uspto-grants-2015_10
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09150555B2
来源说明: uspto-grants-2015_10

反应 SMILES

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