HRID858058

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CN(C(=O)OC(C)(C)C)c1ccc(CC(=O)Nc2c(N)[nH]c(=O)n(Cc3ccccc3F)c2=O)cc1

HCID58762829

未命名化合物

结构：CC(C)(C)OC(=O)Nc1ccc(CC(=O)Nc2c(N)n(CC3CC3)c(=O)n(Cc3ccccc3F)c2=O)cc1

HCID58762834

未命名化合物

PRODUCTS

生成物

HCID10730397

未命名化合物

结构：CN(C(=O)OC(C)(C)C)c1ccc(CC(=O)Nc2c(N)n(CC3CC3)c(=O)n(Cc3ccccc3F)c2=O)cc1

HCID58762840

未命名化合物

PROCEDURE

实验过程

Prepared by the same procedure as described for the preparation of (4-{[6-amino-1-cyclopropylmethyl-3-(2-fluoro-benzyl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidin-5-ylcarbamoyl]-methyl}-phenyl)-carbamic acid tert-butyl ester (example 1, step 5) except that (4-{[6-amino-3-(2-fluoro-benzyl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidin-5-ylcarbamoyl]-methyl}-phenyl)-methyl-carbamic acid tert-butyl ester was used in place of (4-{[6-amino-1-cyclopropylmethyl-3-(2-fluoro-benzyl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidin-5-ylcarbamoyl]-methyl}-phenyl)-carbamic acid tert-butyl ester. Purified by chromatography using silica eluted with 3% v/v methanol in chloroform to give (4-{[6-amino-1-cyclopropylmethyl-3-(2-fluoro-benzyl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidin-5-ylcarbamoyl]-methyl}-phenyl)-methyl-carbamic acid tert-butyl ester as a colorless solid foam (63% yield from [4-(tert-butoxycarbonyl-methyl-amino)-phenyl]-acetic acid).

WORKUP

后处理

customPrepared by the same procedure
customPurified by chromatography
washeluted with 3% v/v methanol in chloroform

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-10682bec2b8b4f7daa9668f3df637933
来源数据集: uspto-grants-2006_12
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07148229B2
来源说明: uspto-grants-2006_12

反应 SMILES

[C:1]([O:5][C:6](=[O:39])[NH:7][C:8]1[CH:13]=[CH:12][C:11]([CH2:14][C:15](=[O:38])[NH:16][C:17]2[C:18](=[O:37])[N:19]([CH2:29][C:30]3[CH:35]=[CH:34][CH:33]=[CH:32][C:31]=3[F:36])[C:20](=[O:28])[N:21]([CH2:24][CH:25]3[CH2:27][CH2:26]3)[C:22]=2[NH2:23])=[CH:10][CH:9]=1)([CH3:4])([CH3:3])[CH3:2].[C:40]([O:44][C:45](=[O:75])[N:46]([C:48]1[CH:53]=[CH:52][C:51]([CH2:54][C:55](=[O:74])NC2C(=O)N(CC3C=CC=CC=3F)C(=O)NC=2N)=[CH:50][CH:49]=1)[CH3:47])([CH3:43])([CH3:42])[CH3:41]>>[C:1]([O:5][C:6](=[O:39])[N:7]([C:8]1[CH:9]=[CH:10][C:11]([CH2:14][C:15](=[O:38])[NH:16][C:17]2[C:18](=[O:37])[N:19]([CH2:29][C:30]3[CH:35]=[CH:34][CH:33]=[CH:32][C:31]=3[F:36])[C:20](=[O:28])[N:21]([CH2:24][CH:25]3[CH2:26][CH2:27]3)[C:22]=2[NH2:23])=[CH:12][CH:13]=1)[CH3:40])([CH3:4])([CH3:2])[CH3:3].[C:40]([O:44][C:45]([N:46]([CH3:47])[C:48]1[CH:49]=[CH:50][C:51]([CH2:54][C:55]([OH:74])=[O:5])=[CH:52][CH:53]=1)=[O:75])([CH3:41])([CH3:42])[CH3:43]