HRID79739

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COC(=O)NC(C(=O)N1CCCC1c1ncc(-c2ccc(N3CCN(C(=O)OCc4ccccc4)CC3)cc2)n1COCC[Si](C)(C)C)C(C)C

HCID66620260

未命名化合物

PRODUCTS

生成物

结构：COC(=O)NC(C(=O)N1CCCC1c1ncc(-c2ccc(N3CCNCC3)cc2)n1COCC[Si](C)(C)C)C(C)C

HCID66620632

未命名化合物

收率 89.2%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID702

Ethanol

C2H6O

PROCEDURE

实验过程

4-{4-[2-[1-(2-Methoxycarbonylamino-3-methyl-butyryl)-pyrrolidin-2-yl]-3-(2-trimethylsilanyl-ethoxymethyl)-3H-imidazol-4-yl]-phenyl}-piperazine-1-carboxylic acid benzyl ester (166 mg, 0.23 mmol) in EtOH (2.5 mL) was treated with 20% PdOH/C (60 mg) and placed under an atmosphere of H2. The reaction was stirred for 18 hours and filtered through a CELITE plug to afford crude (2-methyl-1-{2-[5-(4-piperazin-1-yl-phenyl)-1-(2-trimethylsilanyl-ethoxymethyl)-1H-imidazol-2-yl]-pyrrolidine-1-carbonyl}-propyl)-carbamic acid methyl ester (120 mg), which was used without further purification: MS (ESI) m/z 585 [M+H]+.

WORKUP

后处理

filtrationfiltered through a CELITE plug

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2a4f9a8761cb4b00b59a7dbd0704db32
来源数据集: uspto-grants-2014_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08841278B2
来源说明: uspto-grants-2014_09

反应 SMILES

C(OC([N:11]1[CH2:16][CH2:15][N:14]([C:17]2[CH:22]=[CH:21][C:20]([C:23]3[N:24]([CH2:44][O:45][CH2:46][CH2:47][Si:48]([CH3:51])([CH3:50])[CH3:49])[C:25]([CH:28]4[CH2:32][CH2:31][CH2:30][N:29]4[C:33](=[O:43])[CH:34]([NH:38][C:39]([O:41][CH3:42])=[O:40])[CH:35]([CH3:37])[CH3:36])=[N:26][CH:27]=3)=[CH:19][CH:18]=2)[CH2:13][CH2:12]1)=O)C1C=CC=CC=1>CCO>[CH3:42][O:41][C:39](=[O:40])[NH:38][CH:34]([C:33]([N:29]1[CH2:30][CH2:31][CH2:32][CH:28]1[C:25]1[N:24]([CH2:44][O:45][CH2:46][CH2:47][Si:48]([CH3:50])([CH3:51])[CH3:49])[C:23]([C:20]2[CH:21]=[CH:22][C:17]([N:14]3[CH2:13][CH2:12][NH:11][CH2:16][CH2:15]3)=[CH:18][CH:19]=2)=[CH:27][N:26]=1)=[O:43])[CH:35]([CH3:37])[CH3:36]