HRID2271709

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID66716402

未命名化合物

结构：CC(=O)c1cnc2ccc(Br)cc2c1N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1

HCID178467071

未命名化合物

PRODUCTS

生成物

结构：CC(=O)c1cnc2ccc(-c3cc(F)c(O)c(F)c3)cc2c1N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1

HCID178467125

未命名化合物

收率 59%

PROCEDURE

实验过程

Following general procedure D, tert-butyl trans-4-(3-acetyl-6-bromoquinolin-4-ylamino)cyclohexylcarbamate (47 mg, 0.100 mmol) was reacted with 2,6-difluoro-4-(3,3,4,4-tetramethylborolan-1-yl)phenol (97 mg, 0.382 mmol) to afford the desired product (30 mg, 59%) as a yellow solid: ESI MS m/z 512 [C28H31F2N3O4+H]+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4bc8be69b97e47d5bebb947b51a62045
来源数据集: uspto-grants-2015_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09120749B2
来源说明: uspto-grants-2015_09

反应 SMILES

[C:1]([C:4]1[CH:5]=[N:6][C:7]2[C:12]([C:13]=1[NH:14][C@H:15]1[CH2:20][CH2:19][C@H:18]([NH:21][C:22](=[O:28])[O:23][C:24]([CH3:27])([CH3:26])[CH3:25])[CH2:17][CH2:16]1)=[CH:11][C:10](Br)=[CH:9][CH:8]=2)(=[O:3])[CH3:2].[F:30][C:31]1[CH:36]=[C:35](B2CC(C)(C)C(C)(C)C2)[CH:34]=[C:33]([F:46])[C:32]=1[OH:47]>>[C:1]([C:4]1[CH:5]=[N:6][C:7]2[C:12]([C:13]=1[NH:14][C@H:15]1[CH2:20][CH2:19][C@H:18]([NH:21][C:22](=[O:28])[O:23][C:24]([CH3:27])([CH3:26])[CH3:25])[CH2:17][CH2:16]1)=[CH:11][C:10]([C:35]1[CH:36]=[C:31]([F:30])[C:32]([OH:47])=[C:33]([F:46])[CH:34]=1)=[CH:9][CH:8]=2)(=[O:3])[CH3:2]