259089-67-3
| Name | 1H-Pyrrole-2-carboxylic acid, 1-(4-fluorophenyl)-, 2-[thioxo[[3-(trifluoromethyl)phenyl]amino]methyl]hydrazide |
| CAS | 259089-67-3 |
| Molecular Formula | C19H14F4N4OS |
| Molecular Weight | 422.4 |
| MOL File | 259089-67-3.mol |
Chemical Properties
| density | 1.40±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | DMSO: 2mg/mL, clear |
| form | powder |
| pka | 9.19±0.70(Predicted) |
| color | white to beige |
| InChI | 1S/C19H14F4N4OS/c20-13-6-8-15(9-7-13)27-10-2-5-16(27)17(28)25-26-18(29)24-14-4-1-3-12(11-14)19(21,22)23/h1-11H,(H,25,28)(H2,24,26,29) |
| InChIKey | QEJONNSHVNSZBJ-UHFFFAOYSA-N |
| SMILES | FC(F)(F)c1cc(ccc1)NC(=S)NNC(=O)c2[n](ccc2)c3ccc(cc3)F |