HRID718637

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：Brc1c(C#Cc2ccc3ccccc3n2)nc2c(N3CCOCC3)ccnn12

HCID117728374

未命名化合物

结构：CC(C)[C@H](NC(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1)C(=O)OC(C)(C)C

HCID123812944

未命名化合物

PRODUCTS

生成物

结构：CC(C)[C@H](NC(=O)c1ccc(-c2c(C#Cc3ccc4ccccc4n3)nc3c(N4CCOCC4)ccnn23)cc1)C(=O)OC(C)(C)C

HCID117732500

未命名化合物

PROCEDURE

实验过程

Compound 18b was subjected to Suzuki coupling conditions with compound 43a as described in Example 38, Step A to obtain compound 43b as a yellow solid. Mass Spectrum (LCMS, ESI pos.): Calcd. for C32H38N6O4: 631.3 (M+H). Found: 631.0.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b65b542d3df940708e2f91c23990ec91
来源数据集: uspto-grants-2015_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09193736B2
来源说明: uspto-grants-2015_11

反应 SMILES

Br[C:2]1[N:6]2[N:7]=[CH:8][CH:9]=[C:10]([N:11]3[CH2:16][CH2:15][O:14][CH2:13][CH2:12]3)[C:5]2=[N:4][C:3]=1[C:17]#[C:18][C:19]1[CH:28]=[CH:27][C:26]2[C:21](=[CH:22][CH:23]=[CH:24][CH:25]=2)[N:20]=1.[CH3:29][CH:30]([CH3:57])[C@H:31]([NH:39][C:40](=[O:56])[C:41]1[CH:46]=[CH:45][C:44](B2OC(C)(C)C(C)(C)O2)=[CH:43][CH:42]=1)[C:32]([O:34][C:35]([CH3:38])([CH3:37])[CH3:36])=[O:33]>>[CH3:29][CH:30]([CH3:57])[C@H:31]([NH:39][C:40](=[O:56])[C:41]1[CH:42]=[CH:43][C:44]([C:2]2[N:6]3[N:7]=[CH:8][CH:9]=[C:10]([N:11]4[CH2:16][CH2:15][O:14][CH2:13][CH2:12]4)[C:5]3=[N:4][C:3]=2[C:17]#[C:18][C:19]2[CH:28]=[CH:27][C:26]3[C:21](=[CH:22][CH:23]=[CH:24][CH:25]=3)[N:20]=2)=[CH:45][CH:46]=1)[C:32]([O:34][C:35]([CH3:38])([CH3:37])[CH3:36])=[O:33]