HRID706562

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID20443148

1,4-Dioxane hydrochloride

C4H9ClO2

结构：Cc1nn(Cc2cccc(C3CC3)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)[C@@H](C)C5)ccn34)c12

HCID57384859

未命名化合物

PRODUCTS

生成物

结构：Cc1nn(Cc2cccc(C3CC3)n2)c2cccc(NC(=O)c3cnc4cc(OCCN5CCN(C)[C@@H](C)C5)ccn34)c12.Cl.Cl

HCID67977228

未命名化合物

收率 100%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID21226129

未命名化合物

PROCEDURE

实验过程

(S)—N-(1-((6-cyclopropylpyridin-2-yl)methyl)-3-methyl-1H-indazol-4-yl)-7-(2-(3,4-dimethylpiperazin-1-yl)ethoxy)imidazo[1,2-a]pyridine-3-carboxamide (81.6 mg, 0.141 mmol) was taken up in 2 mL of 4:1 DCM/MeOH-4M HCl/dioxane (0.071 mL, 0.282 mmol) was added and the mixture stirred at ambient temperature for one hour, then concentrated under reduced pressure and dried under vacuum for 16 hours to give 91.9 mgs (100%) of the HCl salt. [α]D=−3.6° (c=1.0, CHCl3).

WORKUP

后处理

additionwas added
concentrationconcentrated under reduced pressure
customdried under vacuum for 16 hours

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6d8a32c1d3c042e1bd2e728d380717b7
来源数据集: uspto-grants-2015_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09174981B2
来源说明: uspto-grants-2015_11

反应 SMILES

[CH:1]1([C:4]2[N:9]=[C:8]([CH2:10][N:11]3[C:19]4[C:14](=[C:15]([NH:20][C:21]([C:23]5[N:27]6[CH:28]=[CH:29][C:30]([O:32][CH2:33][CH2:34][N:35]7[CH2:40][CH2:39][N:38]([CH3:41])[C@@H:37]([CH3:42])[CH2:36]7)=[CH:31][C:26]6=[N:25][CH:24]=5)=[O:22])[CH:16]=[CH:17][CH:18]=4)[C:13]([CH3:43])=[N:12]3)[CH:7]=[CH:6][CH:5]=2)[CH2:3][CH2:2]1.[ClH:44].O1CCOCC1>C(Cl)Cl.CO>[ClH:44].[ClH:44].[CH:1]1([C:4]2[N:9]=[C:8]([CH2:10][N:11]3[C:19]4[C:14](=[C:15]([NH:20][C:21]([C:23]5[N:27]6[CH:28]=[CH:29][C:30]([O:32][CH2:33][CH2:34][N:35]7[CH2:40][CH2:39][N:38]([CH3:41])[C@@H:37]([CH3:42])[CH2:36]7)=[CH:31][C:26]6=[N:25][CH:24]=5)=[O:22])[CH:16]=[CH:17][CH:18]=4)[C:13]([CH3:43])=[N:12]3)[CH:7]=[CH:6][CH:5]=2)[CH2:3][CH2:2]1