≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads 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.
| Pubchem Sid | 504773005 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504773005 |
| Canonical Smiles | CC(C)OC1=C(C=CC(=C1)Cl)CNC2=CC(=NC3=NC=NN23)C4=CC=CC=C4 |
| IUPAC Name | N-[(4-chloro-2-propan-2-yloxyphenyl)methyl]-5-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine |
| InChIKey | WBYNZQXAAWPAGR-UHFFFAOYSA-N |
| INCHI | 1S/C21H20ClN5O/c1-14(2)28-19-10-17(22)9-8-16(19)12-23-20-11-18(15-6-4-3-5-7-15)26-21-24-13-25-27(20)21/h3-11,13-14,23H,12H2,1-2H3 |
| Molecular Weight | 393.87 |
| Reaxy-Rn | 27522219 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=27522219&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 K2317257 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317258 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317259 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317260 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317261 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317262 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317362 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317363 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317364 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| K2317365 | Certificate of Analysis | Oct 25, 2023 | A288554 |
| Solubility | Solvent:DMSO, Max Conc. mg/mL: 39.39, Max Conc. mM: 100 |
|---|---|
| Molecular Weight | 393.900 g/mol |
| XLogP3 | 5.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 393.136 Da |
| Monoisotopic Mass | 393.136 Da |
| Topological Polar Surface Area | 64.300 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 489.000 |
| 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 |
