HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl isocyanatoacetate → HCID 57947668, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Ethyl isocyanatoacetate | HCID 76283 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | HCID 57947596 | HCID 57947596 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Product | HCID 57947668 | HCID 57947668 | 80% |
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
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08895582B2 |
| Source dataset | uspto-grants-2014_11 |
| ORD ID | ord-b48f2124cee84b8dbc1bb96814e9fbf1 |
| Source note | uspto-grants-2014_11 |