HRID81417

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11430

Potassium Carbonate

CK2O3

HCID31268

Pyrrolidine

C4H9N

结构：CC(C)Cn1c(=O)n(C)c(=O)c2c(Nc3ccccc3)n(Cc3ccc(CBr)cc3)nc21

HCID68736539

未命名化合物

PRODUCTS

生成物

结构：CC(C)Cn1c(=O)n(C)c(=O)c2c(Nc3ccccc3)n(Cc3ccc(CN4CCCC4)cc3)nc21

HCID42609881

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID8028

Tetrahydrofuran

C4H8O

PROCEDURE

实验过程

2-(4-(bromomethyl)benzyl)-7-isobutyl-5-methyl-3-(phenylamino)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione (30 mg, 0.06 mmol), K2CO3 (16 mg, 0.12 mmol) and pyrrolidine (10 μL, 0.12 mmol) in THF is stirred at room temperature for 2 days. The mixture is then purified by HPLC to give final product as white powder. MS (ESI) m/z 487.3 [M+H]+.

WORKUP

后处理

customThe mixture is then purified by HPLC

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-53857049b1db476190e9d916f7add385
来源数据集: uspto-grants-2014_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08846693B2
来源说明: uspto-grants-2014_09

反应 SMILES

Br[CH2:2][C:3]1[CH:32]=[CH:31][C:6]([CH2:7][N:8]2[C:16]([NH:17][C:18]3[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=3)=[C:15]3[C:10]([N:11]([CH2:27][CH:28]([CH3:30])[CH3:29])[C:12](=[O:26])[N:13]([CH3:25])[C:14]3=[O:24])=[N:9]2)=[CH:5][CH:4]=1.C([O-])([O-])=O.[K+].[K+].[NH:39]1[CH2:43][CH2:42][CH2:41][CH2:40]1>C1COCC1>[CH2:27]([N:11]1[C:10]2=[N:9][N:8]([CH2:7][C:6]3[CH:31]=[CH:32][C:3]([CH2:2][N:39]4[CH2:43][CH2:42][CH2:41][CH2:40]4)=[CH:4][CH:5]=3)[C:16]([NH:17][C:18]3[CH:23]=[CH:22][CH:21]=[CH:20][CH:19]=3)=[C:15]2[C:14](=[O:24])[N:13]([CH3:25])[C:12]1=[O:26])[CH:28]([CH3:29])[CH3:30]