HRID905628

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11430

Potassium Carbonate

CK2O3

HCID82111

N-(3-Aminopropyl)pyrrolidin-2-one

C7H14N2O

HCID10014651

(3-Bromomethyl-phenyl)-acetic acid methyl ester

C10H11BrO2

反应SMILES：CCCCOc1nc(N)c2nc(OC)n(CCCCBr)c2n1

HCID23158511

未命名化合物

PRODUCTS

产物

反应SMILES：CCCCOc1nc(N)c2[nH]c(=O)n(CCCCN(CCCN3CCCC3=O)Cc3cccc(CC(=O)OC)c3)c2n1

HCID11706932

未命名化合物

PROCEDURE

实验过程

Using the compound obtained in Example 2-13 step (i) (400 mg), 1-(3-aminopropyl)pyrrolidin-2-on (1 ml), potassium carbonate (175 mg) and methyl [3-(bromomethyl)phenyl]acetate (175 mg), the same manner to Example 2-29 was conducted to give the titled compound as a white solid. Yield: 200 mg (48%); mp 115-116° C., MS APCI+ve 582 (M+H).

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-a94aecfc11e145699ab7f13ffb1d6ef7
来源数据集: uspto-grants-2011_09
DOI: 10.6084/m9.figshare.5104873.v1
专利号: US08012964B2
来源说明: uspto-grants-2011_09

反应SMILES

Br[CH2:2][CH2:3][CH2:4][CH2:5][N:6]1[C:14]([O:15]C)=[N:13][C:12]2[C:7]1=[N:8][C:9]([O:18][CH2:19][CH2:20][CH2:21][CH3:22])=[N:10][C:11]=2[NH2:17].[NH2:23][CH2:24][CH2:25][CH2:26][N:27]1[CH2:31][CH2:30][CH2:29][C:28]1=[O:32].C(=O)([O-])[O-].[K+].[K+].Br[CH2:40][C:41]1[CH:42]=[C:43]([CH2:47][C:48]([O:50][CH3:51])=[O:49])[CH:44]=[CH:45][CH:46]=1>>[NH2:17][C:11]1[N:10]=[C:9]([O:18][CH2:19][CH2:20][CH2:21][CH3:22])[N:8]=[C:7]2[C:12]=1[NH:13][C:14](=[O:15])[N:6]2[CH2:5][CH2:4][CH2:3][CH2:2][N:23]([CH2:40][C:41]1[CH:42]=[C:43]([CH2:47][C:48]([O:50][CH3:51])=[O:49])[CH:44]=[CH:45][CH:46]=1)[CH2:24][CH2:25][CH2:26][N:27]1[CH2:31][CH2:30][CH2:29][C:28]1=[O:32]