HRID1009310

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2734334

2,4-Difluorophenylboronic acid

C6H5BF2O2

结构：CC(C)C[C@H](N[C@@H](c1ccc(Br)cc1)c1nccs1)C(=O)NC1(C#N)CC1

HCID67298346

未命名化合物

PRODUCTS

生成物

结构：CC(C)C[C@H](N[C@@H](c1ccc(-c2ccc(F)cc2F)cc1)c1nccs1)C(=O)NC1(C#N)CC1

HCID59715509

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

结构：Cl[Pd]Cl.[Fe+2].c1ccc(P(c2ccccc2)[c-]2cccc2)cc1.c1ccc(P(c2ccccc2)[c-]2cccc2)cc1

催化剂HCID178418228

Bis(cyclopenta-1,4-dien-1-yl(diphenyl)phosphane);dichloropalladium;iron(2+)

C34H28Cl2FeP2Pd

PROCEDURE

实验过程

The title compound was prepared via the Suzuki cross-coupling of (2S)-2-{(S)-[(4-bromophenyl)-thiazol-2-yl-methyl]-amino}-4-methylpentanoic acid (1-cyanocyclopropyl)-amide with 2,4-difluorobenzeneboronic acid, in the presence of [1,1′-bis(diphenylphosphino)ferrocene]dichloropalladium(II), dichloromethane complex. MS (−ESI): 479 [M−1]−

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-da434fb1d52c444aab6ff8f12a87ba79
来源数据集: uspto-grants-2011_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07973037B2
来源说明: uspto-grants-2011_07

反应 SMILES

[C:1]([C:3]1([NH:6][C:7](=[O:27])[C@@H:8]([NH:13][C@@H:14]([C:20]2[CH:25]=[CH:24][C:23](Br)=[CH:22][CH:21]=2)[C:15]2[S:16][CH:17]=[CH:18][N:19]=2)[CH2:9][CH:10]([CH3:12])[CH3:11])[CH2:5][CH2:4]1)#[N:2].[F:28][C:29]1[CH:34]=[C:33]([F:35])[CH:32]=[CH:31][C:30]=1B(O)O>C1C=CC(P(C2C=CC=CC=2)[C-]2C=CC=C2)=CC=1.C1C=CC(P(C2C=CC=CC=2)[C-]2C=CC=C2)=CC=1.Cl[Pd]Cl.[Fe+2]>[C:1]([C:3]1([NH:6][C:7](=[O:27])[C@@H:8]([NH:13][C@@H:14]([C:20]2[CH:25]=[CH:24][C:23]([C:32]3[CH:31]=[CH:30][C:29]([F:28])=[CH:34][C:33]=3[F:35])=[CH:22][CH:21]=2)[C:15]2[S:16][CH:17]=[CH:18][N:19]=2)[CH2:9][CH:10]([CH3:12])[CH3:11])[CH2:5][CH2:4]1)#[N:2]