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10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -80°C Ships Dry ice packs + Cold packs Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
inhibitor of protein kinases
| ALogP | 4.326 |
|---|---|
| HBD-Zahl | 1 |
| Rotationsfähige Bindung | 5 |
| Pubchem Sid | 528768004 |
|---|---|
| Kanonisches Lächeln | C1=CC=C2C(=C1)N=C(S2)NC(=O)CSC3=NN4C(=NN=C4C5=CC=C(C=C5)F)C=C3 |
| IUPAC Name | N-(1,3-benzothiazol-2-yl)-2-[[3-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl]acetamide |
| InChIKey | PMLZUMPMDYBWIH-UHFFFAOYSA-N |
| INCHI | 1S/C20H13FN6OS2/c21-13-7-5-12(6-8-13)19-25-24-16-9-10-18(26-27(16)19)29-11-17(28)23-20-22-14-3-1-2-4-15(14)30-20/h1-10H,11H2,(H,22,23,28) |
| Isomere SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)CSC3=NN4C(=NN=C4C5=CC=C(C=C5)F)C=C3 |
| PubChem CID | 16815081 |
| Molekulargewicht | 436.49 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →| DMSO (mM) Maximale Löslichkeit | 10 |
|---|---|
| Molekulargewicht | 436.500 g/mol |
| XLogP3 | 4.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 436.058 Da |
| Monoisotopic Mass | 436.058 Da |
| Topological Polar Surface Area | 139.000 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 610.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |