HRID22313

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID152932

1-(Bis(4-fluorophenyl)methyl)piperazine

C17H18F2N2

HCID5460307

Fumerate

C4H2O4-2

HCID19927657

未命名化合物

PRODUCTS

生成物

结构：COc1cc2ccc(=O)oc2cc1OCCCN1CCN(C(c2ccc(F)cc2)c2ccc(F)cc2)CC1

HCID19927711

未命名化合物

收率 76%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID180

Acetone

C3H6O

PROCEDURE

实验过程

Method B (36 h at 60° C.); starting materials: 7-[3-(methanesulfonyloxy)propoxy]-6-methoxy-2H-1-benzopyran-2-one (example 68) and 1-[bis(4-fluorophenyl)methyl]-piperazine; yield 76% Ol. Fumarate: method E; yield 82%; fusion point 200°-202° C. (from acetone).

WORKUP

后处理

customMethod B (36 h at 60° C.)

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-68a7679b0ce54db087202d42cef063b1
来源数据集: uspto-grants-1995_06
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05428038

反应 SMILES

CS(O[CH2:6][CH2:7][CH2:8][O:9][C:10]1[C:20]([O:21][CH3:22])=[CH:19][C:13]2[CH:14]=[CH:15][C:16](=[O:18])[O:17][C:12]=2[CH:11]=1)(=O)=O.[F:23][C:24]1[CH:29]=[CH:28][C:27]([CH:30]([C:37]2[CH:42]=[CH:41][C:40]([F:43])=[CH:39][CH:38]=2)[N:31]2[CH2:36][CH2:35][NH:34][CH2:33][CH2:32]2)=[CH:26][CH:25]=1.C([O-])(=O)/C=C/C([O-])=O>CC(C)=O>[F:43][C:40]1[CH:39]=[CH:38][C:37]([CH:30]([C:27]2[CH:28]=[CH:29][C:24]([F:23])=[CH:25][CH:26]=2)[N:31]2[CH2:32][CH2:33][N:34]([CH2:6][CH2:7][CH2:8][O:9][C:10]3[C:20]([O:21][CH3:22])=[CH:19][C:13]4[CH:14]=[CH:15][C:16](=[O:18])[O:17][C:12]=4[CH:11]=3)[CH2:35][CH2:36]2)=[CH:42][CH:41]=1