HRID1660970

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID46838908

4-[(4-Methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)aniline

C13H18F3N3

结构：COc1ccc(-c2ccc3c(c2)ncn3-c2ccc(CC(=O)O)cc2)cc1

HCID67021579

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(-c2ccc3c(c2)ncn3-c2ccc(CC(=O)Nc3ccc(CN4CCN(C)CC4)c(C(F)(F)F)c3)cc2)cc1

HCID11993288

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID21226129

未命名化合物

PROCEDURE

实验过程

The title compound is prepared as described in Example 1 but using {4-[5-(4-methoxy-phenyl)-benzoimidazol-1-yl]-phenyl}-acetic acid and 4-(4-methyl-piperazin-1-ylmethyl)-3-trifluoromethyl-phenylamine (WO 03/099771). Title compound: ES-MS: 613.9 [M+H]+; single peak at tR=3.56 min (System 1); Rf=0.10 (CH2Cl2/MeOH+1% NH3aq, 9:1).

WORKUP

后处理

customThe title compound is prepared

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-53d6cf6fed1641c79fb8773b3cbb70a5
来源数据集: uspto-grants-2011_10
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08030311B2
来源说明: uspto-grants-2011_10

反应 SMILES

[CH3:1][O:2][C:3]1[CH:8]=[CH:7][C:6]([C:9]2[CH:27]=[CH:26][C:12]3[N:13]([C:16]4[CH:21]=[CH:20][C:19]([CH2:22][C:23]([OH:25])=O)=[CH:18][CH:17]=4)[CH:14]=[N:15][C:11]=3[CH:10]=2)=[CH:5][CH:4]=1.[CH3:28][N:29]1[CH2:34][CH2:33][N:32]([CH2:35][C:36]2[CH:41]=[CH:40][C:39]([NH2:42])=[CH:38][C:37]=2[C:43]([F:46])([F:45])[F:44])[CH2:31][CH2:30]1>C(Cl)Cl.CO>[CH3:1][O:2][C:3]1[CH:4]=[CH:5][C:6]([C:9]2[CH:27]=[CH:26][C:12]3[N:13]([C:16]4[CH:17]=[CH:18][C:19]([CH2:22][C:23]([NH:42][C:39]5[CH:40]=[CH:41][C:36]([CH2:35][N:32]6[CH2:31][CH2:30][N:29]([CH3:28])[CH2:34][CH2:33]6)=[C:37]([C:43]([F:46])([F:45])[F:44])[CH:38]=5)=[O:25])=[CH:20][CH:21]=4)[CH:14]=[N:15][C:11]=3[CH:10]=2)=[CH:7][CH:8]=1