HRID2040837

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID20132751

Methyl azetidine-3-carboxylate

C5H9NO2

结构：Cc1cc(-c2nc(-c3ccc(CC(=O)O)cc3)no2)cc(CC(C)C)n1

HCID59234753

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(-c2nc(-c3ccc(CC(=O)N4CC(C(=O)O)C4)cc3)no2)cc(CC(C)C)n1

HCID59234752

未命名化合物

结构：COC(=O)C1CN(C(=O)Cc2ccc(-c3noc(-c4cc(C)nc(CC(C)C)c4)n3)cc2)C1

HCID68555643

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID18323598

未命名化合物

PROCEDURE

实验过程

1-(2-{4-[5-(2-Isobutyl-6-methyl-pyridin-4-yl)-[1,2,4]oxadiazol-3-yl]-phenyl}-acetyl)-azetidine-3-carboxylic acid methyl ester is prepared from {4-[5-(2-isobutyl-6-methyl-pyridin-4-yl)-[1,2,4]oxadiazol-3-yl]-phenyl}-acetic acid and azetidine-3-carboxylic acid methyl ester in analogy to Example 65; stirring this material in 3 N aq. NaOH/dioxane at rt for 20 h gives 1-(2-{4-[5-(2-isobutyl-6-methyl-pyridin-4-yl)-[1,2,4]oxadiazol-3-yl]-phenyl}-acetyl)-azetidine-3-carboxylic acid; LC-MS: tR=0.80, [M+1]+=435.02.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-36e69c82e9184889a8b8c7379ede49ec
来源数据集: uspto-grants-2013_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08580824B2
来源说明: uspto-grants-2013_11

反应 SMILES

[CH2:1]([C:5]1[CH:10]=[C:9]([C:11]2[O:15][N:14]=[C:13]([C:16]3[CH:21]=[CH:20][C:19]([CH2:22][C:23](O)=[O:24])=[CH:18][CH:17]=3)[N:12]=2)[CH:8]=[C:7]([CH3:26])[N:6]=1)[CH:2]([CH3:4])[CH3:3].[CH3:27][O:28][C:29]([CH:31]1[CH2:34][NH:33][CH2:32]1)=[O:30]>[OH-].[Na+].O1CCOCC1>[CH3:27][O:28][C:29]([CH:31]1[CH2:34][N:33]([C:23](=[O:24])[CH2:22][C:19]2[CH:20]=[CH:21][C:16]([C:13]3[N:12]=[C:11]([C:9]4[CH:8]=[C:7]([CH3:26])[N:6]=[C:5]([CH2:1][CH:2]([CH3:3])[CH3:4])[CH:10]=4)[O:15][N:14]=3)=[CH:17][CH:18]=2)[CH2:32]1)=[O:30].[CH2:1]([C:5]1[CH:10]=[C:9]([C:11]2[O:15][N:14]=[C:13]([C:16]3[CH:17]=[CH:18][C:19]([CH2:22][C:23]([N:33]4[CH2:34][CH:31]([C:29]([OH:28])=[O:30])[CH2:32]4)=[O:24])=[CH:20][CH:21]=3)[N:12]=2)[CH:8]=[C:7]([CH3:26])[N:6]=1)[CH:2]([CH3:4])[CH3:3]