HRID927298

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID334024

6-methylquinazoline-2,4(1H,3H)-dione

C9H8N2O2

HCID22645461

Methyl 5-(bromomethyl)-2-fluorobenzoate

C9H8BrFO2

结构：COC(=O)c1cccc(Cn2c(=O)[nH]c(=O)c3ccccc32)c1

HCID68388893

未命名化合物

结构：Cc1ccc2c(c1)c(=O)[nH]c(=O)n2Cc1ccc(F)c(C(=O)O)c1

HCID68388966

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc2c(c1)c(=O)[nH]c(=O)n2Cc1cccc(C(=O)N2CCN(C(=O)C3CCCC3)CC2)c1

HCID68388814

未命名化合物

PROCEDURE

实验过程

The following compounds were prepared from 1-(3-carboxy-4-fluorobenzyl)-6-methylquinazoline-2,4(1H,3H)-dione (prepared from 6-methylquinazoline-2,4(1H,3H)-dione and methyl 5-(bromomethyl)-2-fluorobenzoate using a procedure similar to those for compounds of Example 1 and 2), and the corresponding substituted piperazine using a procedure similar to those described for the synthesis of compound of Example 3.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d5d54f0cd3e64478926fcf1e72ac573a
来源数据集: uspto-grants-2016_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09290460B2
来源说明: uspto-grants-2016_03

反应 SMILES

[C:1]([C:4]1[CH:5]=[C:6]([CH:21]=[CH:22][C:23]=1F)[CH2:7][N:8]1[C:17]2[C:12](=[CH:13][C:14]([CH3:18])=[CH:15][CH:16]=2)[C:11](=[O:19])[NH:10][C:9]1=[O:20])([OH:3])=O.CC1[CH:27]=[C:28]2[C:33](=[CH:34][CH:35]=1)N[C:31](=O)[NH:30][C:29]2=[O:37].BrCC1C=CC(F)=C(C=1)C(OC)=O.COC(C1C=[C:57](C=CC=1)[CH2:58][N:59]1C2C(=CC=CC=2)C(=O)N[C:60]1=O)=O>>[CH:28]1([C:29]([N:30]2[CH2:31][CH2:60][N:59]([C:1]([C:4]3[CH:5]=[C:6]([CH:21]=[CH:22][CH:23]=3)[CH2:7][N:8]3[C:17]4[C:12](=[CH:13][C:14]([CH3:18])=[CH:15][CH:16]=4)[C:11](=[O:19])[NH:10][C:9]3=[O:20])=[O:3])[CH2:58][CH2:57]2)=[O:37])[CH2:27][CH2:35][CH2:34][CH2:33]1