HRID19817

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC(C)(C)c1ccc(CN(CCc2ccc(OCc3ccccc3)c(C(C)(C)C)c2)C(=O)c2cc(C(F)(F)F)cc(Cl)c2F)cc1

HCID68564096

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)c1ccc(CN(CCc2ccc(O)c(C(C)(C)C)c2)C(=O)c2cc(C(F)(F)F)cc(Cl)c2F)cc1

HCID86613998

未命名化合物

收率 82.9%

AUXILIARIES

试剂、催化剂与溶剂

催化剂HCID23938

Palladium

溶剂HCID8857

Ethyl acetate

C4H8O2

PROCEDURE

实验过程

A solution of 182 mg of N-[2-(4-benzyloxy-3-tert-butyl-phenyl)-ethyl]-N-(4-tert-butyl-benzyl)-3-chloro-2-fluoro-5-trifluoromethyl-benzamide (0.278 mmol) in 15 ml ethyl acetate were hydrogenated over 100 mg Pd/C-5%. After completion of the reaction the suspension was filtered off and concentrated in vacuo. The resulting residue was purified by flash column chromatography (Heptane/AcOEt:90/10) to yield 130 mg of a colorless viscous oil. MS (ISP) 564 (M+H)+.

WORKUP

后处理

customAfter completion of the reaction the suspension
filtrationwas filtered off
concentrationconcentrated in vacuo
customThe resulting residue was purified by flash column chromatography (Heptane/AcOEt:90/10)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5e73ff236b9a4c618e8f5e9b3d9c2c94
来源数据集: uspto-grants-2010_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07745477B2
来源说明: uspto-grants-2010_06

反应 SMILES

C([O:8][C:9]1[CH:14]=[CH:13][C:12]([CH2:15][CH2:16][N:17]([CH2:32][C:33]2[CH:38]=[CH:37][C:36]([C:39]([CH3:42])([CH3:41])[CH3:40])=[CH:35][CH:34]=2)[C:18](=[O:31])[C:19]2[CH:24]=[C:23]([C:25]([F:28])([F:27])[F:26])[CH:22]=[C:21]([Cl:29])[C:20]=2[F:30])=[CH:11][C:10]=1[C:43]([CH3:46])([CH3:45])[CH3:44])C1C=CC=CC=1>C(OCC)(=O)C.[Pd]>[C:39]([C:36]1[CH:35]=[CH:34][C:33]([CH2:32][N:17]([CH2:16][CH2:15][C:12]2[CH:13]=[CH:14][C:9]([OH:8])=[C:10]([C:43]([CH3:46])([CH3:45])[CH3:44])[CH:11]=2)[C:18](=[O:31])[C:19]2[CH:24]=[C:23]([C:25]([F:27])([F:26])[F:28])[CH:22]=[C:21]([Cl:29])[C:20]=2[F:30])=[CH:38][CH:37]=1)([CH3:40])([CH3:42])[CH3:41]