HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 1807751Erstellt: 24. Oktober 2026
4-Nitrophenyl chloroformate → 1-(5-tert-Butylisoxazol-3-yl)-3-(2-fluoro-4-(4-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)benzyl)piperazine-1-carbonyl)phenyl)urea
https://huagongshe.com/de/reaction/1807751
Beteiligte Stoffe
| Rolle | Name | HCID | Einwaage |
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| Edukt | 4-Nitrophenyl chloroformate | HCID 82129 | — |
| Edukt | 3-Isoxazolamine, 5-(1,1-dimethylethyl)- | HCID 171473 | — |
| Edukt | (4-Amino-3-fluorophenyl)(4-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)benzyl)piperazin-1-yl)methanone | HCID 86638550 | — |
| Lösungsmittel | Tetrahydrofuran | HCID 8028 | — |
| Produkt | 1-(5-tert-Butylisoxazol-3-yl)-3-(2-fluoro-4-(4-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)benzyl)piperazine-1-carbonyl)phenyl)urea | HCID 44512154 | 5,2% |
Reaktionsschritte
(4-Amino-3-fluorophenyl)(4-(4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)benzyl)piperazin-1-yl)methanone (0.417 mmol, 0.2 g) and 4-nitrophenyl carbono-chloridate (0.417 mmol, 0.084 g) were combined and stirred in tetrahydrofuran (2 mL) at room temperature for 1 hour. 5-tert-Butylisoxazol-3-amine (1.252 mmol, 0.175 g) was added and the reaction heated in the microwave to 120° C. for 10 minutes. The solvent was removed at reduced pressure and the resulting residue purified by silica column chromatography (eluant dichloromethane/methanol 0% to 5%) to afford the title compound (14 mg). MS (ESI) m/z 646.5 [M+H]+
Herkunft & Nachweise
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patentnummer | US08357679B2 |
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| Quelldatensatz | uspto-grants-2013_01 |
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| ORD ID | ord-da286ada38ad4812941d8e9424fecd87 |
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| Quellennotiz | uspto-grants-2013_01 |
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