HRID1476293

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：O=C(O)c1ccc(N2CCC([C@@H](O)c3ccccc3-c3ccc(Cl)cc3)CC2)cc1

HCID58080224

未命名化合物

2 次

结构：CN(CCOP(=O)(OC(C)(C)C)OC(C)(C)C)CC[C@H](CSc1ccccc1)Nc1ccc(S(N)(=O)=O)cc1S(=O)(=O)C(F)(F)F

HCID66723794

未命名化合物

2 次

PRODUCTS

生成物

结构：CN(CCOP(=O)(OC(C)(C)C)OC(C)(C)C)CC[C@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCC([C@@H](O)c4ccccc4-c4ccc(Cl)cc4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F

HCID87125252

未命名化合物

收率 61.5%

PROCEDURE

实验过程

A similar procedure to that described for INTERMEDIATE 55 utilizing (R)-4-(4-((4′-chlorobiphenyl-2-yl)(hydroxy)methyl)piperidin-1-yl)benzoic acid (INTERMEDIATE 40, 63 mg, 0.14 mmol) and (R)-di-tert-butyl 2-(methyl(4-(phenylthio)-3-(4-sulfamoyl-2-(trifluoromethylsulfonyl)phenylamino)butyl)amino)ethyl phosphate (INTERMEDIATE 54, 105 mg, 0.14 mmol) as starting materials was followed, with subsequent purification by column chromatography (ISCO, 0→100% EtOAc/hexane followed by 0→10% MeOH/EtOAc) to give the title product (98 mg, yield: 60%).

WORKUP

后处理

customwas followed, with subsequent purification by column chromatography (ISCO, 0→100% EtOAc/hexane followed by 0→10% MeOH/EtOAc)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2327073dc905458bab2839e74d45e222
来源数据集: uspto-grants-2015_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09018381B2
来源说明: uspto-grants-2015_04

反应 SMILES

[Cl:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[CH:13]=[CH:12][CH:11]=[CH:10][C:9]=2[C@H:14]([OH:30])[CH:15]2[CH2:20][CH2:19][N:18]([C:21]3[CH:29]=[CH:28][C:24]([C:25](O)=[O:26])=[CH:23][CH:22]=3)[CH2:17][CH2:16]2)=[CH:4][CH:3]=1.[P:31]([O:43][CH2:44][CH2:45][N:46]([CH3:76])[CH2:47][CH2:48][C@@H:49]([NH:58][C:59]1[CH:64]=[CH:63][C:62]([S:65](=[O:68])(=[O:67])[NH2:66])=[CH:61][C:60]=1[S:69]([C:72]([F:75])([F:74])[F:73])(=[O:71])=[O:70])[CH2:50][S:51][C:52]1[CH:57]=[CH:56][CH:55]=[CH:54][CH:53]=1)([O:38][C:39]([CH3:42])([CH3:41])[CH3:40])([O:33][C:34]([CH3:37])([CH3:36])[CH3:35])=[O:32]>>[P:31]([O:43][CH2:44][CH2:45][N:46]([CH2:47][CH2:48][C@@H:49]([NH:58][C:59]1[CH:64]=[CH:63][C:62]([S:65](=[O:68])(=[O:67])[NH:66][C:25](=[O:26])[C:24]2[CH:28]=[CH:29][C:21]([N:18]3[CH2:19][CH2:20][CH:15]([C@H:14]([C:9]4[CH:10]=[CH:11][CH:12]=[CH:13][C:8]=4[C:5]4[CH:4]=[CH:3][C:2]([Cl:1])=[CH:7][CH:6]=4)[OH:30])[CH2:16][CH2:17]3)=[CH:22][CH:23]=2)=[CH:61][C:60]=1[S:69]([C:72]([F:74])([F:75])[F:73])(=[O:71])=[O:70])[CH2:50][S:51][C:52]1[CH:57]=[CH:56][CH:55]=[CH:54][CH:53]=1)[CH3:76])([O:33][C:34]([CH3:35])([CH3:37])[CH3:36])([O:38][C:39]([CH3:42])([CH3:41])[CH3:40])=[O:32]