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HRID1486056

反应详情

EQUATION

反应方程式

HRID 1486056 的结构方程式

REACTANTS

反应物

1
结构：Cc1c(Cl)nc2ccccc2c1CN1C(=O)[C@@H](NC(=O)[C@H](C)N(C)C(=O)OC(C)(C)C)[C@H](C)N(C(=O)CS(C)(=O)=O)c2ccccc21
HCID118292663

未命名化合物

PRODUCTS

生成物

1
结构：CN[C@@H](C)C(=O)N[C@@H]1C(=O)N(Cc2c(C)c(Cl)nc3ccccc23)c2ccccc2N(C(=O)CS(C)(=O)=O)[C@H]1C.Cl
HCID73427180

未命名化合物

收率 158.1%

AUXILIARIES

试剂、催化剂与溶剂

3
结构：Cl
溶剂HCID313

Hydrochloric Acid

ClH

结构：CCOCC
溶剂HCID3283

Diethyl Ether

C4H10O

结构：C1COCCO1
溶剂HCID31275

1,4-Dioxane

C4H8O2

PROCEDURE

实验过程

A rt suspension of tert-butyl(S)-1-((3S,4S)-1-((2-chloro-3-methylquinolin-4-yl)methyl)-4-methyl-5-(2-(methylsulfonyl)acetyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-3-ylamino)-1-oxopropan-2-yl(methyl)carbamate (61.6 mg, 89.8 μmol) in 4 M HCl in dioxane (449 μl) was stirred for 2 h. The reaction was diluted with Et2O and the solids were collected by vacuum filtration, taken up in MeCN—H2O, and lyophilized to provide (S)-N-((3S,4S)-1-((2-chloro-3-methylquinolin-4-yl)methyl)-4-methyl-5-(2-(methylsulfonyl)acetyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-3-yl)-2-(methylamino)propanamide hydrochloride (44.2 mg, 79%) as a white solid. MS m/z 586 (MH)+.

WORKUP

后处理

  1. filtrationthe solids were collected by vacuum filtration