HRID844892

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID22382040

2-Chloro-6-methylbenzoyl chloride

C8H6Cl2O

结构：CC(=O)OC(C)OC(=O)[C@@H](N)Cc1ccc(-c2c(C)n(C)c(=O)n(C)c2=O)cc1

HCID69335837

未命名化合物

PRODUCTS

生成物

结构：CC(=O)OC(C)OC(=O)[C@H](Cc1ccc(-c2c(C)n(C)c(=O)n(C)c2=O)cc1)NC(=O)c1c(C)cccc1Cl

HCID10120246

未命名化合物

PROCEDURE

实验过程

N-[(2-chloro-6-methylphenyl)carbonyl]-4-(1,3,6-trimethyl-2,4-dioxo-5-pyrimidinyl)-L-phenylalanine 1-(acetoxy)ethyl ester was prepared from 4-(1,3,6-trimethyl-2,4-dioxo-5-pyrimidinyl)-L-phenylalanine 1-(acetoxy)ethyl ester and 2-chloro-6-methylbenzoyl chloride using the general procedures described in example 33 and was obtained as a white solid: mp 84-88° C. ES-HRMS m/e calcd for C28H30ClN3O7 (M+Na) 578.1664, found 578.1665.

WORKUP

后处理

customwas obtained as a white solid

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-faf6df88ab6144eabea896afb84e172a
来源数据集: uspto-grants-2002_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06380387B1
来源说明: uspto-grants-2002_04

反应 SMILES

[C:1]([O:4][CH:5]([O:7][C:8](=[O:29])[C@H:9]([CH2:11][C:12]1[CH:17]=[CH:16][C:15]([C:18]2[C:19](=[O:28])[N:20]([CH3:27])[C:21](=[O:26])[N:22]([CH3:25])[C:23]=2[CH3:24])=[CH:14][CH:13]=1)[NH2:10])[CH3:6])(=[O:3])[CH3:2].[Cl:30][C:31]1[CH:39]=[CH:38][CH:37]=[C:36]([CH3:40])[C:32]=1[C:33](Cl)=[O:34]>>[C:1]([O:4][CH:5]([O:7][C:8](=[O:29])[C@H:9]([CH2:11][C:12]1[CH:13]=[CH:14][C:15]([C:18]2[C:19](=[O:28])[N:20]([CH3:27])[C:21](=[O:26])[N:22]([CH3:25])[C:23]=2[CH3:24])=[CH:16][CH:17]=1)[NH:10][C:33]([C:32]1[C:36]([CH3:40])=[CH:37][CH:38]=[CH:39][C:31]=1[Cl:30])=[O:34])[CH3:6])(=[O:3])[CH3:2]