HRID1832477

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2735732

4-Chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carbonyl chloride

C9H7Cl2N3O

结构：CC(C)C(=O)Nc1cccc(C2CCN(CC[C@H](N)c3ccccc3)CC2)c1

HCID69523474

未命名化合物

PRODUCTS

生成物

结构：Cc1nn(C)c2ncc(C(=O)N[C@@H](CCN3CCC(c4cccc(NC(=O)C(C)C)c4)CC3)c3ccccc3)c(Cl)c12

HCID58651319

未命名化合物

PROCEDURE

实验过程

Prepared by Procedure Q1 and Scheme AC using N-(3-{1-((3S)-3-amino-3-phenylpropyl]-4-piperidinyl}phenyl)-2-methylpropanamide and 4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carbonyl chloride: ESMS m/e: 587.3 (M+H)+.

WORKUP

后处理

customPrepared by Procedure Q1 and Scheme AC

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-261d294431c24ec99a8a798c14458c7e
来源数据集: uspto-grants-2006_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07067534B1
来源说明: uspto-grants-2006_06

反应 SMILES

[NH2:1][C@H:2]([C:23]1[CH:28]=[CH:27][CH:26]=[CH:25][CH:24]=1)[CH2:3][CH2:4][N:5]1[CH2:10][CH2:9][CH:8]([C:11]2[CH:12]=[C:13]([NH:17][C:18](=[O:22])[CH:19]([CH3:21])[CH3:20])[CH:14]=[CH:15][CH:16]=2)[CH2:7][CH2:6]1.[Cl:29][C:30]1[C:35]([C:36](Cl)=[O:37])=[CH:34][N:33]=[C:32]2[N:39]([CH3:43])[N:40]=[C:41]([CH3:42])[C:31]=12>>[Cl:29][C:30]1[C:35]([C:36]([NH:1][C@H:2]([C:23]2[CH:24]=[CH:25][CH:26]=[CH:27][CH:28]=2)[CH2:3][CH2:4][N:5]2[CH2:10][CH2:9][CH:8]([C:11]3[CH:16]=[CH:15][CH:14]=[C:13]([NH:17][C:18](=[O:22])[CH:19]([CH3:21])[CH3:20])[CH:12]=3)[CH2:7][CH2:6]2)=[O:37])=[CH:34][N:33]=[C:32]2[N:39]([CH3:43])[N:40]=[C:41]([CH3:42])[C:31]=12