HRID634940

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID69858

2,3,5,6-Tetrafluorophenol

C6H2F4O

HCID522689

Potassium fluoride

HCID21226206

未命名化合物

结构：CC(C)Cc1c(C(=O)N(C2CCCCC2)[C@@H](C)C(=O)NC(CC(=O)OC(C)(C)C)C(=O)CBr)n(C)c2ccccc12

HCID86756366

未命名化合物

PRODUCTS

生成物

结构：CC(C)Cc1c(C(=O)N(C2CCCCC2)[C@@H](C)C(=O)NC(CC(=O)OC(C)(C)C)C(=O)COc2c(F)c(F)cc(F)c2F)n(C)c2ccccc12

HCID86756365

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6228

N,N-Dimethylformamide

C3H7NO

PROCEDURE

实验过程

The titled product was prepared as described in Example 82 using N-[(1-methyl-3-isobutyl-indole-2-carbonyl)cyclohexylalaninyl]-3-amino-5-bromo-4-oxo-pentanoic acid, tert-butyl ester (50.8 mg, 0.08 mmol), potassium fluoride (12.0 mg, 0.21 mmol), and 2,3,5,6-tetrafluorophenol (13.3 mg, 0.08 mmol) in DMF (2.0 ml). TLC (hexane/EtOAc, 3/1): Rf=0.25.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-96643832e51949ff81e8b303e1c84318
来源数据集: uspto-grants-2001_02
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06184244B2
来源说明: uspto-grants-2001_02

反应 SMILES

[CH3:1][N:2]1[C:10]2[C:5](=[CH:6][CH:7]=[CH:8][CH:9]=2)[C:4]([CH2:11][CH:12]([CH3:14])[CH3:13])=[C:3]1[C:15]([N:17]([CH:36]1[CH2:41][CH2:40][CH2:39][CH2:38][CH2:37]1)[C@H:18]([C:20]([NH:22][CH:23]([C:32](=[O:35])[CH2:33]Br)[CH2:24][C:25]([O:27][C:28]([CH3:31])([CH3:30])[CH3:29])=[O:26])=[O:21])[CH3:19])=[O:16].[F-].[K+].[F:44][C:45]1[C:50]([F:51])=[CH:49][C:48]([F:52])=[C:47]([F:53])[C:46]=1[OH:54].CCCCCC.CCOC(C)=O>CN(C=O)C>[CH3:1][N:2]1[C:10]2[C:5](=[CH:6][CH:7]=[CH:8][CH:9]=2)[C:4]([CH2:11][CH:12]([CH3:14])[CH3:13])=[C:3]1[C:15]([N:17]([CH:36]1[CH2:41][CH2:40][CH2:39][CH2:38][CH2:37]1)[C@H:18]([C:20]([NH:22][CH:23]([C:32](=[O:35])[CH2:33][O:54][C:46]1[C:47]([F:53])=[C:48]([F:52])[CH:49]=[C:50]([F:51])[C:45]=1[F:44])[CH2:24][C:25]([O:27][C:28]([CH3:31])([CH3:30])[CH3:29])=[O:26])=[O:21])[CH3:19])=[O:16]