HRID2053919

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID14798

Sodium Hydroxide

HNaO

HCID24526

Chlorine

Cl2

HCID22609213

未命名化合物

结构：COC(=O)Cn1c(C(Cc2ccc(O)cc2)NC(=O)c2ccc(C(=O)N3CCCC3)c(C)c2)nc2ccc(Cl)cc21

HCID59655244

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C(=O)NC(Cc2ccc(O)cc2)c2nc3ccc(Cl)cc3n2CC(=O)O)ccc1C(=O)N1CCCC1

HCID59655253

未命名化合物

收率 79%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID887

Methanol

CH4O

PROCEDURE

实验过程

Prepared analogously to Example 19b from rac.-N-{1-[6-chloro-1-(methoxycarbonylmethyl)-1H-benzimidazol-2-yl]-2-(4-hydroxyphenyl)ethyl}-3-methyl-4-(pyrrolidin-1-ylcarbonyl)benzamide and sodium hydroxide solution in methanol. Yield: 79%; Rf value: 0.18 (silica gel; dichloromethane/ethanol/ammonia=9:1:0.1); C30H29ClN4O5 (561.04); mass spectrum: (M+H)+=561/563 (chlorine isotope).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-38488ebb9f1e4dda9516bf74190264e9
来源数据集: uspto-grants-2008_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07326791B2
来源说明: uspto-grants-2008_02

反应 SMILES

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