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BDTX-189 Structure

BDTX-189

Chemical Properties

Boiling point 778.0±60.0 °C(Predicted)
Density  1.349±0.06 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO:22.56(Max Conc. mg/mL);40.21(Max Conc. mM)
DMF:1.0(Max Conc. mg/mL);1.78(Max Conc. mM)
DMF:PBS (pH 7.2) (1:2):0.3(Max Conc. mg/mL);0.53(Max Conc. mM)
form  A solid
pka 12.20±0.43(Predicted)
color  Off-white to light yellow
InChIKey HIBPKFXWOPYJPZ-UHFFFAOYSA-N
SMILES C(NC1C(OCCN2CCOCC2)=CC2C(C=1)=C(NC1=CC=C(OCC3=NC=CC=C3)C(Cl)=C1)N=CN=2)(=O)C=C

Usage And Synthesis

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