HRID50198

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID14798

Sodium Hydroxide

HNaO

结构：COC(=O)C1Cc2ccccc2N1C(=O)c1cnc2c(c1)nc(CCc1ccc(C(=N)N)cc1)n2C.Cl

HCID18412357

未命名化合物

HCID86587043

未命名化合物

PRODUCTS

生成物

结构：Cl.Cn1c(CCc2ccc(C(=N)N)cc2)nc2cc(C(=O)N3c4ccccc4CC3C(=O)O)cnc21

HCID18412659

未命名化合物

收率 90%

PROCEDURE

实验过程

Prepared analogously to Example 2 from 2-[2-(4-amidinophenyl)ethyl]-3-methyl-6-(2-methoxycarbonyl-2,3-dihydroindol-1-yl-carbonyl)imidazo[4,5-b]pyridine hydrochloride and sodium hydroxide solution. Yield: 90% of theory, C26H24N6O3 (468.52); Rf value: 0.24 (silica gel; ethyl acetate/ethanol/ammonia=50:45:5); EKA mass spectrum: (M+H)+=469; (M+Na)+=491.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fe5b0b0228cc4c038b08de92e024fca2
来源数据集: uspto-grants-2004_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06710055B2
来源说明: uspto-grants-2004_03

反应 SMILES

[ClH:1].[C:2]([C:5]1[CH:10]=[CH:9][C:8]([CH2:11][CH2:12][C:13]2[N:36]([CH3:37])[C:16]3=[N:17][CH:18]=[C:19]([C:21]([N:23]4[C:31]5[C:26](=[CH:27][CH:28]=[CH:29][CH:30]=5)[CH2:25][CH:24]4[C:32]([O:34]C)=[O:33])=[O:22])[CH:20]=[C:15]3[N:14]=2)=[CH:7][CH:6]=1)(=[NH:4])[NH2:3].[OH-].[Na+].C(OCC)(=O)C.C(O)C.N>>[ClH:1].[C:2]([C:5]1[CH:6]=[CH:7][C:8]([CH2:11][CH2:12][C:13]2[N:36]([CH3:37])[C:16]3=[N:17][CH:18]=[C:19]([C:21]([N:23]4[C:31]5[C:26](=[CH:27][CH:28]=[CH:29][CH:30]=5)[CH2:25][CH:24]4[C:32]([OH:34])=[O:33])=[O:22])[CH:20]=[C:15]3[N:14]=2)=[CH:9][CH:10]=1)(=[NH:3])[NH2:4]