HRID132883

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

结构：CC(C)(C)NC(=O)c1cc2c(nc1C(F)(F)F)CN(C(=O)C[C@@H](Cc1cc(F)ccc1F)NC(=O)OC(C)(C)C)CC2

HCID69223621

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)NC(=O)c1cc2c(nc1C(F)(F)F)CN(C(=O)C[C@H](N)Cc1cc(F)ccc1F)CC2.Cl

HCID131726934

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID31275

1,4-Dioxane

C4H8O2

PROCEDURE

实验过程

A solution of the product (25 mg) from Step A above, 0.5 mL of methanol and 2.5 mL of 4.0M hydrogen chloride in 1,4-dioxane was kept at room temperature for 18 h. The volatiles were removed under a stream of nitrogen, and the residue was triturated with ether. The resultant precipitate was collected and dried in vacuo to afford the title compound as a white powder. LC/MS: 499.1 (M+1).

WORKUP

后处理

customThe volatiles were removed under a stream of nitrogen
customthe residue was triturated with ether
customThe resultant precipitate was collected
customdried in vacuo

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d0fd6093702b4b0a9554dfca04347752
来源数据集: uspto-grants-2008_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07388019B2
来源说明: uspto-grants-2008_06

反应 SMILES

C(OC([NH:8][C@H:9]([CH2:34][C:35]1[CH:40]=[C:39]([F:41])[CH:38]=[CH:37][C:36]=1[F:42])[CH2:10][C:11]([N:13]1[CH2:22][C:21]2[N:20]=[C:19]([C:23]([F:26])([F:25])[F:24])[C:18]([C:27]([NH:29][C:30]([CH3:33])([CH3:32])[CH3:31])=[O:28])=[CH:17][C:16]=2[CH2:15][CH2:14]1)=[O:12])=O)(C)(C)C.CO.[ClH:45]>O1CCOCC1>[ClH:45].[NH2:8][C@H:9]([CH2:34][C:35]1[CH:40]=[C:39]([F:41])[CH:38]=[CH:37][C:36]=1[F:42])[CH2:10][C:11]([N:13]1[CH2:22][C:21]2[N:20]=[C:19]([C:23]([F:26])([F:24])[F:25])[C:18]([C:27]([NH:29][C:30]([CH3:32])([CH3:33])[CH3:31])=[O:28])=[CH:17][C:16]=2[CH2:15][CH2:14]1)=[O:12]