Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1917180Generated: November 2, 2026

Methanol → tert-Butyl 2-(methyl(2-(7-nitro-2H-benzo[b][1,4]thiazin-4(3H)-yl)ethyl)amino)acetate

https://huagongshe.com/reaction/1917180

Reaction equation

Participants

RoleNameHCIDCharge
ReactantMethanolHCID 887—
Reactanttert-Butyl bromoacetateHCID 79177—
ReactantDiisopropylethylamineHCID 81531—
ReactantN-Methyl-2-(7-nitro-2H-benzo[b][1,4]thiazin-4(3H)-yl)ethanamineHCID 59144162—
SolventDimethylformamideHCID 6228—
SolventDichloromethaneHCID 6344—
SolventSodium chloride; waterHCID 57417360—
Producttert-Butyl 2-(methyl(2-(7-nitro-2H-benzo[b][1,4]thiazin-4(3H)-yl)ethyl)amino)acetateHCID 59144161—

Reaction Steps

A solution of N-methyl-2-(7-nitro-2H-benzo[b][1,4]thiazin-4(3H)-yl)ethanamine (0.95 g, 3.75 mmol), diisopropylethyl amine (1.960 mL, 11.25 mmol), and tert-butyl bromoacetate (0.61 mL, 4.13 mmol) in DMF (20 mL) was heated at 55° C. for 17 hours (overnight). The yellow solution was diluted with brine (40 mL) and extracted with EtOAc (100 mL). The organic extract was separated and rinsed with brine (20 mL). The organic layer was dried (Na2SO4), filtered, and concentrated to give a yellow residue. This residue was subjected to flash chromatography on silica gel using 2.5:97.5 MeOH:CH2Cl2 to give a yellow brown residue. Two fractions were collected, with the latter containing a non-polar yellow spot (950 mg, 68.9%). 1H-NMR (CDCl3) δ 7.96 (d, J=2.7 Hz, 1H), 7.88 (d, J=2.7, 9.3 Hz, 1H), 6.65 (d, J=9.3 Hz, 1H), 3.88-3.83 (m, 2H), 3.55 (t, J=7.2 Hz, 2H), 3.20 (s, 2H), 3.02-2.99 (m, 2H), 2.76 (t, J=7.2 Hz, 2H), 2.44 (s, 3H), 1.46 (s, 9H); ESI-MS (m/z, %): 368 (MH+, 20), 312 (100).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08618286B2
Source datasetuspto-grants-2013_12
ORD IDord-df3777cc71ae4a6fa235b98e83b28568
Source noteuspto-grants-2013_12