HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Fluorophenyl isocyanate → HCID 89443462, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 3-Fluorophenyl isocyanate | HCID 123064 | — |
| Reactant | HCID 89462331 | HCID 89462331 | — |
| Solvent | Dichloromethane | HCID 6344 | — |
| Product | HCID 89443462 | HCID 89443462 | 16.7% |
Reaction Steps
To a solution of (3-amino-2,6-difluorophenyl)(quinoxalin-6-yl)methanone (40 mg, 0.15 mmol, 1.0 eq.) in DCM (5 mL) were added TEA (42.4 mg, 0.42 mmol, 3.0 eq.) and 1-fluoro-3-isocyanatobenzene (23.3 mg, 0.17 mmol, 1.2 eq.). The resulting mixture was stirred at rt for 1 h, then concentrated. The resulting residue was purified via flash column chromatography (PE/EA=1/1, v/v) to afford 1-(2,4-difluoro-3-(quinoxaline-6-carbonyl)phenyl)-3-(3-fluorophenyl)urea (10.5 mg, 16.7%). LRMS (M−H+) m/z caculated 423.1. found 423.1. 1H NMR (DMSO-d6, 400 MHz) δ 9.31 (s, 1H), 9.11-9.13 (d, 2H), 8.76 (s, 1H), 8.46 (s, 1H), 8.33-8.34 (m, 3H), 7.49-7.52 (d, 1H), 7.32-7.35 (m, 2H), 7.10-7.12 (d, 1H), 6.82 (t, 1H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US09249110B2 |
| Source dataset | uspto-grants-2016_02 |
| ORD ID | ord-e90eca4e9429412eba9febc6ab645165 |
| Source note | uspto-grants-2016_02 |