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Deferasirox Ethyl Ester Structure

Deferasirox Ethyl Ester

Chemical Properties

Melting point 148-151°C
Boiling point 638.4±65.0 °C(Predicted)
Density  1.31±0.1 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  DMSO (Slightly), Methanol (Slightly, Heated)
pka 8.02±0.35(Predicted)
form  Solid
color  White to Light Yellow
InChI InChI=1S/C23H19N3O4/c1-2-30-23(29)15-11-13-16(14-12-15)26-22(18-8-4-6-10-20(18)28)24-21(25-26)17-7-3-5-9-19(17)27/h3-14,27-28H,2H2,1H3
InChIKey DBCPWOQZLXYJNM-UHFFFAOYSA-N
SMILES C(OCC)(=O)C1=CC=C(N2C(C3=CC=CC=C3O)=NC(C3=CC=CC=C3O)=N2)C=C1

Usage And Synthesis

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