1350653-30-3

Name 2-[5-fluoro-1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidine-4,5,6-triamine
CAS 1350653-30-3
EINECS(EC#) 811-934-0
Molecular Formula C17H14F2N8
MDL Number MFCD26517131
Molecular Weight 368.34
MOL File 1350653-30-3.mol
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Chemical Properties

Boiling point  550.1±50.0 °C(Predicted)
density  1.49 at 20℃
vapor pressure  0Pa at 20℃
pka 2.45±0.30(Predicted)
InChI InChI=1S/C17H14F2N8/c18-9-5-10-13(16-24-14(21)12(20)15(22)25-16)26-27(17(10)23-6-9)7-8-3-1-2-4-11(8)19/h1-6H,7,20H2,(H4,21,22,24,25)
InChIKey DVTLORLSDKRODH-UHFFFAOYSA-N
SMILES C1(C2C3=CC(F)=CN=C3N(CC3=CC=CC=C3F)N=2)=NC(N)=C(N)C(N)=N1
LogP 2.83 at 20℃ and pH6

Safety Data

Symbol(GHS)  Environment (GHS09)
GHS09
Signal word  Warning
Hazard statements  H410
Precautionary statements  P273-P391-P501

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