1393477-72-9

Name KPT-330
CAS 1393477-72-9
Molecular Formula C17H11F6N7O
MDL Number MFCD27987944
Molecular Weight 443.31
MOL File 1393477-72-9.mol

Chemical Properties

density  1.55±0.1 g/cm3(Predicted)
storage temp.  -20°C
solubility  Soluble in DMSO (up to at least 25 mg/ml). or in Ethanol (up to at least 25 mg/ml)
form  solid
pka 9.74±0.43(Predicted)
color  Off-white
Stability: Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20° for up to 2 months.
InChI InChI=1S/C17H11F6N7O/c18-16(19,20)11-5-10(6-12(7-11)17(21,22)23)15-26-9-30(29-15)4-1-14(31)28-27-13-8-24-2-3-25-13/h1-9H,(H,25,27)(H,28,31)/b4-1-
InChIKey DEVSOMFAQLZNKR-RJRFIUFISA-N
SMILES C(NNC1=NC=CN=C1)(=O)/C=C\N1C=NC(C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)=N1

Hazard Information

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