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HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 1919894Erstellt: 26. Oktober 2026

Acetic Acid → Methyl 4-[4-[(4-chlorophenyl)amino]-3-(4-methylpiperazin-1-yl)-4-oxobutyl]benzoate

https://huagongshe.com/reaction/1919894

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktAcetic AcidHCID 176—
Edukt1-MethylpiperazineHCID 53167—
Edukt4-Chlorophenyl isocyanideHCID 74670—
EduktMethyl 4-(3-oxopropyl)benzoateHCID 10104031—
LösungsmittelMethanolHCID 887—
Lösungsmittel2,2,2-TrifluoroethanolHCID 6409—
ProduktMethyl 4-[4-[(4-chlorophenyl)amino]-3-(4-methylpiperazin-1-yl)-4-oxobutyl]benzoateHCID 57611868—

Reaktionsbedingungen

Temperatur50 °C

Reaktionsschritte

Methyl 4-(3-oxopropyl)benzoate (43.5 mg, 0.226 mmol), 4-chlorophenyl isocyanide (43.5 mg, 0.316 mmol), N-methylpiperazine (40.0 μL, 0.36 mmol) and AcOH (20.0 μL, 0.36 mmol) were dissolved in 100 μL of trifluoroethanol and heated at 50° C. for 3 hours. The reaction mixture was diluted with 2 mL of methanol and purified by reversed phase HPLC to afford the desired product. MS cal'd 430.2 (MH+), exp 430.1 (MH+).

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS08168658B2
Quelldatensatzuspto-grants-2012_05
ORD IDord-819eceeeada54589bf12a9cbdce3df7a
Quellennotizuspto-grants-2012_05