HRID1736113

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID14798

Sodium Hydroxide

HNaO

结构：CCCCCCNc1c(F)cc(F)c2oc(-c3ccc(N(CCCN4C(=O)c5ccccc5C4=O)C(C)=O)c(F)c3)cc(=O)c12

HCID19434853

未命名化合物

PRODUCTS

生成物

结构：CCCCCCNc1c(F)cc(F)c2oc(-c3ccc(NCCCN4C(=O)c5ccccc5C4=O)c(F)c3)cc(=O)c12

HCID15346996

未命名化合物

收率 34%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID702

Ethanol

C2H6O

PROCEDURE

实验过程

200 mg of Compound 31 was dissolved in 4 ml of ethanol, 2 ml of concentrated hydrochloric acid was added and the mixture was heated at reflux for 4 hours. The reaction solution was cooled on ice and adjusted to pH 8 by addition of a 10N aqueous solution of sodium hydroxide thereto, and the precipitated crystals were collected by filtration and subjected to preparative thin layer chromatography (chloroform:acetone=20:1) to give 63 mg (34%) of Compound 32.

WORKUP

后处理

temperaturethe mixture was heated
temperatureat reflux for 4 hours
temperatureThe reaction solution was cooled on ice
filtrationthe precipitated crystals were collected by filtration

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dd89b9180616449ebb064a017466b4bb
来源数据集: uspto-grants-1996_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05539112
来源说明: uspto-grants-1996_07

反应 SMILES

C([N:4]([C:19]1[CH:24]=[CH:23][C:22]([C:25]2[O:26][C:27]3[C:35]([F:36])=[CH:34][C:33]([F:37])=[C:32]([NH:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44])[C:28]=3[C:29](=[O:31])[CH:30]=2)=[CH:21][C:20]=1[F:45])[CH2:5][CH2:6][CH2:7][N:8]1[C:12](=[O:13])[C:11]2=[CH:14][CH:15]=[CH:16][CH:17]=[C:10]2[C:9]1=[O:18])(=O)C.Cl.[OH-].[Na+]>C(O)C>[F:37][C:33]1[CH:34]=[C:35]([F:36])[C:27]2[O:26][C:25]([C:22]3[CH:23]=[CH:24][C:19]([NH:4][CH2:5][CH2:6][CH2:7][N:8]4[C:9](=[O:18])[C:10]5=[CH:17][CH:16]=[CH:15][CH:14]=[C:11]5[C:12]4=[O:13])=[C:20]([F:45])[CH:21]=3)=[CH:30][C:29](=[O:31])[C:28]=2[C:32]=1[NH:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH3:44]