366017-09-6

Name Mubritinib
CAS 366017-09-6
Molecular Formula C25H23F3N4O2
MDL Number MFCD09954135
Molecular Weight 468.47
MOL File 366017-09-6.mol
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Chemical Properties

Melting point  158.0 to 162.0 °C
Boiling point  620.9±65.0 °C(Predicted)
density  1.25±0.1 g/cm3(Predicted)
storage temp.  Store at +4°C
solubility  DMSO : 50 mg/mL (106.73 mM; Need ultrasonic)H2O : < 0.1 mg/mL (insoluble)
form  powder to crystal
pka 1.45±0.10(Predicted)
color  White to Gray to Brown
InChI InChI=1S/C25H23F3N4O2/c26-25(27,28)21-9-4-20(5-10-21)8-13-24-30-22(18-34-24)17-33-23-11-6-19(7-12-23)3-1-2-15-32-16-14-29-31-32/h4-14,16,18H,1-3,15,17H2/b13-8+
InChIKey ZTFBIUXIQYRUNT-MDWZMJQESA-N
SMILES N1(CCCCC2=CC=C(OCC3=COC(/C=C/C4=CC=C(C(F)(F)F)C=C4)=N3)C=C2)C=CN=N1

Safety Data

HS Code  2934.99.4400

Hazard Information

Spectrum Detail

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