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· · COA & SDS available for every product · Same-day shipping on in-stock items KG 5 - ≥98%(HPLC) , CAS No.877874-85-6
Synonyms
2-(Methylthio)-6-[4-[5-[[3-(trifluoromethyl)phenyl]amino]-1H-1,2,4-triazol-3-yl]phenoxy]-4-pyrimidinamine | KG 5 | KG5 | KG-5 | DTXSID501110752 | BDBM205483 | NCGC00480721-01 | NSC754364 | NSC-754364 | 4-Pyrimidinamine, 2-(methylthio)-6-[4-[5-[[3-(trifluo
Shipped In
Ice chest + Ice pads
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Why this grade ≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
2-(Methylthio)-6-[4-[5-[[3-(trifluoromethyl)phenyl]amino]-1H-1, 2, 4-triazol-3-yl]phenoxy]-4-pyrimidinamine | KG 5 | KG5 | KG-5 | DTXSID501110752 | BDBM205483 | NCGC00480721-01 | NSC754364 | NSC-754364 | 4-Pyrimidinamine, 2-(methylthio)-6-[4-[5-[[3-(trifluo
Specifications & Purity
≥98%(HPLC)
Biochemical and Physiological Mechanisms
PDGFRβand B-Raf allosteric inhibitor. Also inhibits c-Raf, FLT3 and KIT. Disrupts blood vessel formation in zebrafish embryos and inhibits angiogenesis in a mouse angiogenesis model. Inhibits growth of renal and pancreatic tumors in mice. Also arrests ce
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles CSC1=NC(=CC(=N1)OC2=CC=C(C=C2)C3=NC(=NN3)NC4=CC=CC(=C4)C(F)(F)F)N IUPAC Name 2-methylsulfanyl-6-[4-[3-[3-(trifluoromethyl)anilino]-1H-1,2,4-triazol-5-yl]phenoxy]pyrimidin-4-amine InChIKey CMYHZFCJPORPHY-UHFFFAOYSA-N INCHI 1S/C20H16F3N7OS/c1-32-19-26-15(24)10-16(27-19)31-14-7-5-11(6-8-14)17-28-18(30-29-17)25-13-4-2-3-12(9-13)20(21,22)23/h2-10H,1H3,(H2,24,26,27)(H2,25,28,29,30) Isomeric SMILES CSC1=NC(=CC(=N1)OC2=CC=C(C=C2)C3=NC(=NN3)NC4=CC=CC(=C4)C(F)(F)F)N PubChem CID 53328059 Molecular Weight 459.45
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organic oxygen compounds Class Organooxygen compounds Subclass Ethers Intermediate Tree Nodes Not available Direct Parent Diarylethers Alternative Parents Phenyl-1,2,4-triazoles Trifluoromethylbenzenes Phenoxy compounds Phenol ethers Aniline and substituted anilines Alkylarylthioethers Aminopyrimidines and derivatives Imidolactams Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Alkyl fluorides Organopnictogen compounds Primary amines Organofluorides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Diaryl ether - Phenyltriazole - Phenyl-1,2,4-triazole - Trifluoromethylbenzene - Phenoxy compound - Aryl thioether - Phenol ether - Aniline or substituted anilines - Aminopyrimidine - Alkylarylthioether - Monocyclic benzene moiety - Pyrimidine - Imidolactam - Benzenoid - Azole - Heteroaromatic compound - Triazole - 1,2,4-triazole - Thioether - Azacycle - Sulfenyl compound - Organoheterocyclic compound - Primary amine - Alkyl halide - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Alkyl fluoride - Amine - Organic nitrogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as diarylethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are aryl groups. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Solvent:DMSO, Max Conc. mg/mL: 45.94, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 45.94, Max Conc. mM: 100 Molecular Weight 459.400 g/mol XLogP3 5.000 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 11 Rotatable Bond Count 6 Exact Mass 459.109 Da Monoisotopic Mass 459.109 Da Topological Polar Surface Area 140.000 Ų Heavy Atom Count 32 Formal Charge 0 Complexity 596.000 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
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