HRID1630420

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID62657

Tripotassium phosphate

K3O4P

HCID2734337

3,4-Difluorophenylboronic acid

C6H5BF2O2

结构：CC1(C)CC(=O)C2=C(C1)Nc1[nH]ncc1C2/C=C/c1ccc(Br)cn1.NC(=O)CC1CC1

HCID137195800

未命名化合物

PRODUCTS

生成物

结构：CC1(C)CC(=O)C2=C(C1)Nc1[nH]ncc1C2/C=C/c1ccc(-c2ccc(F)c(F)c2)cn1.NC(=O)CC1CC1

HCID137195802

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 is prepared according to procedure C from 125 mg of 4-[(E)-2-(5-bromopyridin-2-yl)vinyl]-7,7-dimethyl-5-oxo-4,5,6,7,8,9-hexahydro-1H-pyrazolo[3,4-b]quinoline-3-cyclopropylmethylcarboxamide, 60 mg of 3,4-difluorophenylboronic acid, 134 mg of K3PO4 and 37 mg of 1,1′-bis(diphenylphosphino)ferrocenepalladium dichloride.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-273e0180e1094852985fd8f418249347
来源数据集: uspto-grants-2014_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08791133B2
来源说明: uspto-grants-2014_07

反应 SMILES

Br[C:2]1[CH:3]=[CH:4][C:5](/[CH:8]=[CH:9]/[CH:10]2[C:19]3[C:18](=[O:20])[CH2:17][C:16]([CH3:22])([CH3:21])[CH2:15][C:14]=3[NH:13][C:12]3[NH:23][N:24]=[CH:25][C:11]2=3)=[N:6][CH:7]=1.[CH2:26]1[CH:28]([CH2:29][C:30]([NH2:32])=[O:31])[CH2:27]1.[F:33][C:34]1[CH:35]=[C:36](B(O)O)[CH:37]=[CH:38][C:39]=1[F:40].[O-]P([O-])([O-])=O.[K+].[K+].[K+]>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]>[F:33][C:34]1[CH:35]=[C:36]([C:2]2[CH:3]=[CH:4][C:5](/[CH:8]=[CH:9]/[CH:10]3[C:19]4[C:18](=[O:20])[CH2:17][C:16]([CH3:22])([CH3:21])[CH2:15][C:14]=4[NH:13][C:12]4[NH:23][N:24]=[CH:25][C:11]3=4)=[N:6][CH:7]=2)[CH:37]=[CH:38][C:39]=1[F:40].[CH2:27]1[CH:28]([CH2:29][C:30]([NH2:32])=[O:31])[CH2:26]1