RKI1447
Bezeichnung:RKI1447
CAS-Nr1342278-01-6
Englisch Name:RKI1447
CBNumberCB42660015
SummenformelC16H14N4O2S
Molgewicht326.37
MOL-Datei1342278-01-6.mol
RKI1447 physikalisch-chemischer Eigenschaften
Schmelzpunkt | >205oC (dec.) |
Dichte | 1.408±0.06 g/cm3(Predicted) |
storage temp. | -20°C Freezer |
Löslichkeit | DMSO (Slightly), Methanol (Slightly, Heated) |
pka | 6.36±0.70(Predicted) |
Aggregatzustand | Solid |
Farbe | Pale Yellow to Pale Beige |
InChI | InChI=1S/C16H14N4O2S/c21-13-3-1-2-11(8-13)9-18-15(22)20-16-19-14(10-23-16)12-4-6-17-7-5-12/h1-8,10,21H,9H2,(H2,18,19,20,22) |
InChIKey | GDVRVPIXWXOKQO-UHFFFAOYSA-N |
SMILES | N(CC1=CC=CC(O)=C1)C(NC1=NC(C2C=CN=CC=2)=CS1)=O |