HRID531150

反应详情

EQUATION

反应方程式

REACTANTS

反应物

$反应SMILES：O=C(O)/C=C\C(=O)O$

HCID444266

Maleic acid

C4H4O4

反应SMILES：CCCc1nc2c(cc1C(=O)O)C(=O)N(C1CCN(Cc3cc(C4CC4)c(-c4ccc(F)cc4F)cc3OCC)CC1)CC2

HCID117992290

未命名化合物

PRODUCTS

产物

$反应SMILES：CCCc1nc2c(cc1C(=O)O)C(=O)N(C1CCN(Cc3cc(C4CC4)c(-c4ccc(F)cc4F)cc3OCC)CC1)CC2.O=C(O)/C=C\C(=O)O$

HCID117992289

未命名化合物

收率 67.1%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID702

Ethanol

C2H6O

PROCEDURE

实验过程

Maleic acid (36.1 mg) was added to a mixture of 6-(1-((2-cyclopropyl-5-ethoxy-2′,4′-difluorobiphenyl-4-yl)methyl)piperidin-4-yl)-5-oxo-2-propyl-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carboxylic acid (125 mg) in ethanol (10 mL). The suspension was filtered and the solvent was removed under reduced pressure. The residue was crystallized from ethyl acetate-hexane to give the title compound (100 mg).

WORKUP

后处理

filtrationThe suspension was filtered
customthe solvent was removed under reduced pressure
customThe residue was crystallized from ethyl acetate-hexane

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-f4479b3e12b14ca0be645b8817764206
来源数据集: uspto-grants-2016_05
DOI: 10.6084/m9.figshare.5104873.v1
专利号: US09353108B2
来源说明: uspto-grants-2016_05

反应SMILES

[C:1]([OH:8])(=[O:7])/[CH:2]=[CH:3]\[C:4]([OH:6])=[O:5].[CH:9]1([C:12]2[CH:17]=[C:16]([CH2:18][N:19]3[CH2:24][CH2:23][CH:22]([N:25]4[CH2:34][CH2:33][C:32]5[N:31]=[C:30]([CH2:35][CH2:36][CH3:37])[C:29]([C:38]([OH:40])=[O:39])=[CH:28][C:27]=5[C:26]4=[O:41])[CH2:21][CH2:20]3)[C:15]([O:42][CH2:43][CH3:44])=[CH:14][C:13]=2[C:45]2[CH:50]=[CH:49][C:48]([F:51])=[CH:47][C:46]=2[F:52])[CH2:11][CH2:10]1>C(O)C>[C:1]([OH:8])(=[O:7])/[CH:2]=[CH:3]\[C:4]([OH:6])=[O:5].[CH:9]1([C:12]2[CH:17]=[C:16]([CH2:18][N:19]3[CH2:24][CH2:23][CH:22]([N:25]4[CH2:34][CH2:33][C:32]5[N:31]=[C:30]([CH2:35][CH2:36][CH3:37])[C:29]([C:38]([OH:40])=[O:39])=[CH:28][C:27]=5[C:26]4=[O:41])[CH2:21][CH2:20]3)[C:15]([O:42][CH2:43][CH3:44])=[CH:14][C:13]=2[C:45]2[CH:50]=[CH:49][C:48]([F:51])=[CH:47][C:46]=2[F:52])[CH2:10][CH2:11]1