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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 341014Generated: October 30, 2026

Ethyl isocyanatoacetate → HCID 57947668, compound

https://huagongshe.com/reaction/341014

Reaction equation

Participants

RoleNameHCIDCharge
ReactantEthyl isocyanatoacetateHCID 76283—
ReactantDiisopropylethylamineHCID 81531—
ReactantHCID 57947596HCID 57947596—
SolventTetrahydrofuranHCID 8028—
ProductHCID 57947668HCID 5794766880%

Reaction Steps

To a mixture of (S)-5-amino-2-(3-(2-chloro-3-fluorobenzyl)-1-methylureido)pentyl 6-fluoroisoquinolin-3-ylcarbamate (0.40 g, 0.792 mmol), DIEA (0.276 mL, 1.58 mmol) and THF (2 mL), ethyl isocyanatoacetate (0.108 mL, 0.950 mmol) was added. The mixture was refluxed for 30 min, and concentrated. The remaining residue was purified on silica gel column (DCM/MeOH) to give (S)-ethyl 1-(2-chloro-3-fluorophenyl)-5-((6-fluoroisoquinolin-3-ylcarbamoyloxy)methyl)-4-methyl-3,10-dioxo-2,4,9,11-tetraazatridecan-13-oate (0.40 g, 80%). LRMS (M+H+) m/z 635.6.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08895582B2
Source datasetuspto-grants-2014_11
ORD IDord-b48f2124cee84b8dbc1bb96814e9fbf1
Source noteuspto-grants-2014_11