| Melting point |
182 - 187°C |
| Boiling point |
529.0±60.0 °C(Predicted) |
| Density |
1.43±0.1 g/cm3(Predicted) |
| storage temp. |
Refrigerator |
| solubility |
DMSO (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly) |
| pka |
9.68±0.10(Predicted) |
| color |
Off-White to Brown |
| Major Application |
pharmaceutical (small molecule) |
| InChI |
InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)23(22-15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25) |
| InChIKey |
LGIMTMFJBCXYRP-UHFFFAOYSA-N |
| SMILES |
C1(S(N)(=O)=O)=CC=C(N2C(C(F)(F)F)=CC(C3=CC=C(C)C=C3)=N2)C=C1 |