HRID72541

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)OC(=O)N1CCCC(COc2cccc(F)c2)C1

HCID67958503

未命名化合物

结构：COC(=O)c1ccc(C2(NC(=O)c3cc(Cl)cnc3Cl)CC2)cc1

HCID86697873

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(C2(NC(=O)c3cc(Cl)cnc3N3CCCC(COc4cccc(F)c4)C3)CC2)cc1

HCID67958004

未命名化合物

收率 112%

PROCEDURE

实验过程

The title compound (D203) (97 mg) was prepared according to the experimental procedure described in Description 160 starting from tert-butyl 3-((3-fluorophenoxy)methyl)piperidine-1-carboxylate (D45) (100 mg, 0.323 mmol) and reacting in the second step with methyl 4-(1-(2,5-dichloronicotinamido)cyclopropyl)benzoate (D97) (59 mg, 0.161 mmol).

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fd19a8d074d14285b2fe826d89f7c259
来源数据集: uspto-grants-2014_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08828987B2
来源说明: uspto-grants-2014_09

反应 SMILES

[F:1][C:2]1[CH:3]=[C:4]([CH:20]=[CH:21][CH:22]=1)[O:5][CH2:6][CH:7]1[CH2:12][CH2:11][CH2:10][N:9]([C:13](OC(C)(C)C)=O)[CH2:8]1.ClC1[N:45]=[CH:44][C:43]([Cl:46])=[CH:42][C:25]=1[C:26]([NH:28][C:29]1([C:32]2[CH:41]=[CH:40][C:35]([C:36]([O:38][CH3:39])=[O:37])=[CH:34][CH:33]=2)[CH2:31][CH2:30]1)=[O:27]>>[Cl:46][C:43]1[CH:44]=[N:45][C:13]([N:9]2[CH2:10][CH2:11][CH2:12][CH:7]([CH2:6][O:5][C:4]3[CH:20]=[CH:21][CH:22]=[C:2]([F:1])[CH:3]=3)[CH2:8]2)=[C:25]([CH:42]=1)[C:26]([NH:28][C:29]1([C:32]2[CH:33]=[CH:34][C:35]([C:36]([O:38][CH3:39])=[O:37])=[CH:40][CH:41]=2)[CH2:31][CH2:30]1)=[O:27]