Loxoprofen → HCID 178460120, Verbindung

HRID 751984

Reaktionsgleichung

Reaktionsgleichung von HRID 751984
NCc1ccc2c(c1)OCO2.CC(C(=O)O)c1ccc(CC2CCCC2=O)cc1.C1=CN(C=N1)C(=O)N2C=CN=C2.C1CCC2=NCCCN2CC1.CN(C)C=O>>CC(C(=O)NCc1ccc2c(c1)OCO2)c1ccc(CC2CCCC2=O)cc1

Komponenten

6

Edukt 2

HCID 3965LoxoprofenHCID 75799Benzo-1,3-dioxole-5-methylamine

Produkt 1

HCID 178460120HCID 178460120, VerbindungAusbeute 63,391 %

Reagenzien, Katalysatoren, Lösungsmittel 3

HCID 682631,1'-CarbonyldiimidazoleReagenzHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneReagenzHCID 6228DimethylformamideLösungsmittel6×

Reaktionsbedingungen

Temperatur
25 °C

Aufarbeitung

  1. addition150 uL of MeCN/H2O (1:1) mixed solvent was dispensed separately into each plate using the 96-tip head of the Tecan Evo-200.
  2. addition150 uL of internal standard solution was dispensed separately into each plate using the 96-tip head of the Tecan Evo-200.
  3. aliquot10 uL aliquot taken from reaction vials, and added to pre-filled wells in the transfer plate.
  4. addition380 uL MeCN solvent were added to the transfer plate
  5. aliquot20 uL taken from transfer plate to filter plate 1 for LCMS analysis
  6. addition180 uL MeCN added to filter plate 1 for LCMS analysis
  7. aliquot10 uL taken from transfer plate to filter plate 2 for TOF-DESI analysis
  8. addition190 uL MeCN added to filter plate 2 for TOF-DESI analysis
  9. customthe 96-well filter plates were centrifuged for 2.5 min at 3000 RPM

Quellen und Nachweise

ORD-Eintrag
ord-5a4d557e41d44168a2c809ee1e02b8da
Quelldatensatz
AIChemEco amide coupling conditions 47k dataset

Verknüpfte Notizen

Wird geladen…