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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2056943Generated: October 26, 2026

Toluene → N-(8-bromo-5-isoquinolinyl)-N'-(2,4-dichlorobenzyl)urea

https://huagongshe.com/reaction/2056943

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTolueneHCID 1140—
Reactant2,4-Dichlorobenzyl isocyanateHCID 4612708—
Reactant8-Bromoisoquinolin-5-amineHCID 22032630—
SolventTetrahydrofuranHCID 8028—
ProductN-(8-bromo-5-isoquinolinyl)-N'-(2,4-dichlorobenzyl)ureaHCID 10093879—

Reaction Steps

8-Bromo-5-isoquinolinamine (120 mg, 0.52 mmol) in THF:toluene (5 mL, 1:4) was treated with 2,4-dichloro-1-(isocyanatomethyl)benzene (108 mg, 0.52 mmol) in THF (0.5 mL). After stirring for 16 hours at room temperature, the mixture was filtered and the filter cake was dried under reduced pressure to provide the title compound. MS (ESI+) m/z 426 (M+H)+; MS (ESI−) m/z 424 (M−H)−; 1H NMR (DMSO, 300 MHz) δ 4.42 (d, 5.8, 2H), 7.22 (t, J 5.8, 1H), 7.65 (m, 1H), 7.91 (d, J 8.5, 1H), 8.02 (d, J 6.1, 1H), 8.22 (d, J 8.5, 1H), 8.69 (d, J 5.8, 1H), 9.01 (s, 1H), 9.44 (s, 1H); Anal. Calcd for C17H12BrCl2N3O.HCl+0.25EtOH: C, 44.41; H, 3.14; N, 8.88. Found: C, 44.80; H, 2.76; N, 8.84.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07335678B2
Source datasetuspto-grants-2008_02
ORD IDord-bc055c99031e4c87acb3de351c01a231
Source noteuspto-grants-2008_02