HRID630538

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(=O)OI1(OC(C)=O)(OC(C)=O)OC(=O)c2ccccc21

HCID159087

Triacetoxyperiodinane

C13H13IO8

HCID16217468

(5-Ethoxy-2-fluorophenyl)boronic acid

C8H10BFO3

结构：O=C(c1ccc2c(CO)cn(-c3ncc(Br)cn3)c2c1)N1CCOCC1

HCID118666263

未命名化合物

HCID178418573

未命名化合物

PRODUCTS

生成物

结构：CCOc1ccc(F)c(-c2cnc(-n3cc(C(C)O)c4ccc(C(=O)N5CCOCC5)cc43)nc2)c1

HCID118671990

未命名化合物

PROCEDURE

实验过程

The target compound was prepared from intermediate 27c in three reaction steps comprising a Suzuki reaction with (5-ethoxy-2-fluorophenyl)boronic acid, an oxidation with Dess-Martin periodinane and a Grignard reaction with methylmagnesium bromide. White solid. Yield: 110 mg

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-05bb3ba7f9024c3287587a71a85b346e
来源数据集: uspto-grants-2016_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09315490B2
来源说明: uspto-grants-2016_04

反应 SMILES

Br[C:2]1[CH:3]=[N:4][C:5]([N:8]2[C:16]3[C:11](=[CH:12][CH:13]=[C:14]([C:17]([N:19]4[CH2:24][CH2:23][O:22][CH2:21][CH2:20]4)=[O:18])[CH:15]=3)[C:10]([CH2:25][OH:26])=[CH:9]2)=[N:6][CH:7]=1.[CH2:27]([O:29][C:30]1[CH:31]=[CH:32][C:33]([F:39])=[C:34](B(O)O)[CH:35]=1)[CH3:28].[CH3:40]C(OI1(OC(C)=O)(OC(C)=O)OC(=O)C2C=CC=CC1=2)=O.C[Mg]Br>>[CH2:27]([O:29][C:30]1[CH:31]=[CH:32][C:33]([F:39])=[C:34]([C:2]2[CH:3]=[N:4][C:5]([N:8]3[C:16]4[C:11](=[CH:12][CH:13]=[C:14]([C:17]([N:19]5[CH2:24][CH2:23][O:22][CH2:21][CH2:20]5)=[O:18])[CH:15]=4)[C:10]([CH:25]([OH:26])[CH3:40])=[CH:9]3)=[N:6][CH:7]=2)[CH:35]=1)[CH3:28]