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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2070174Generated: October 30, 2026

3-hydroxy-1,2,3-benzotriazin-4(3H)-one → tert-butyl 2-methyl-1-[(2R)-4-methyl-1-oxo-1-[2-oxo-8-(2-oxopyrrolidin-1-yl)-1-(thiophen-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-ylamino]pentan-2-ylamino]-1-oxopropan-2-ylcarbamate

https://huagongshe.com/reaction/2070174

Reaction equation

Participants

RoleNameHCIDCharge
Reactant3-hydroxy-1,2,3-benzotriazin-4(3H)-oneHCID 73026—
Reactant1,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochlorideHCID 2723939—
Reactant3-amino-8-(2-oxopyrrolidin-1-yl)-1-(thiophen-3-ylmethyl)-3,4-dihydroquinolin-2(1H)-oneHCID 59620330—
Reactant(R)-2-(2-(tert-butoxycarbonylamino)-2-methylpropanamido)-4-methylpentanoic acidHCID 59620349—
SolventDichloromethaneHCID 6344—
SolventTriethylamineHCID 8471—
Producttert-butyl 2-methyl-1-[(2R)-4-methyl-1-oxo-1-[2-oxo-8-(2-oxopyrrolidin-1-yl)-1-(thiophen-3-ylmethyl)-1,2,3,4-tetrahydroquinolin-3-ylamino]pentan-2-ylamino]-1-oxopropan-2-ylcarbamateHCID 44193590—

Reaction Steps

3-Amino-8-(2-oxopyrrolidin-1-yl)-1-(thiophen-3-ylmethyl)-3,4-dihydroquinolin-2(1H)-one (200 mg) and (R)-2-(2-(tert-butoxycarbonylamino)-2-methylpropanamido)-4-methylpentanoic acid (200 mg) were dissolved in dichloromethane (2 mL), and to the solution was added dropwise a solution of 1-ethyl-3-(3-dimethylaminopropyl)carbodiimide hydrochloride (126 mg), 3-hydroxy-4-oxo-3,4-dihydro-1,2,3-benzotriazine (107 mg), and triethylamine (42 μL) in dichloromethane (2 mL) over 10 minutes under cooling on ice, followed by stirring at room temperature for 18 hours. The solvent was evaporated, and the thus-recovered residue was dissolved in ethyl acetate. The solution was sequentially washed with saturated aqueous sodium bicarbonate solution and saturated aqueous sodium chloride solution, and the organic layer was dried over sodium sulfate. The solvent was evaporated under reduced pressure, and the thus-recovered residue was purified through silica gel column chromatography (hexane:ethyl acetate (1:1), chloroform:methanol (10:1)), whereby the title compound (342 mg) was yielded.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08299255B2
Source datasetuspto-grants-2012_10
ORD IDord-c40f94286808406789d2f5211258870d
Source noteuspto-grants-2012_10