HRID340029

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2776500

6-Phenoxynicotinaldehyde

C12H9NO2

结构：Br.Br.Br.CCc1cc(O)c(F)cc1-c1ccc2c(-c3nc4c([nH]3)CCNC4)n[nH]c2c1

HCID178419240

未命名化合物

PRODUCTS

生成物

结构：CCc1cc(O)c(F)cc1-c1ccc2c(-c3nc4c([nH]3)CCN(Cc3ccc(Oc5ccccc5)nc3)C4)n[nH]c2c1

HCID178436910

未命名化合物

收率 33.4%

PROCEDURE

实验过程

The title compound was prepared from 6-phenoxy-pyridine-3-carbaldehyde (39 mg, 198 μmol) and 5-ethyl-2-fluoro-4-[3-(4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-6-yl]-phenol trihydrobromide salt (Preparation 25, 50 mg, 132 μmol) using the method of Example 22. The crude material was purified by HPLC Method A to afford 24.7 mg of the title compound.

WORKUP

后处理

customThe crude material was purified by HPLC Method A

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-acae3ef4fa7c48fe9a6ae733efdca4ba
来源数据集: uspto-grants-2014_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08895544B2
来源说明: uspto-grants-2014_11

反应 SMILES

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