≥95%(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.
| Sonrisas canónicas | CC1=C(SC2=C1C(=NC(C3=NN=C(N32)C)CC(=O)NCC#C)C4=CC=C(C=C4)Cl)C |
|---|---|
| IUPAC Name | 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]-N-prop-2-ynylacetamide |
| InChIKey | ZLSCJWMPQYKVKU-KRWDZBQOSA-N |
| INCHI | 1S/C22H20ClN5OS/c1-5-10-24-18(29)11-17-21-27-26-14(4)28(21)22-19(12(2)13(3)30-22)20(25-17)15-6-8-16(23)9-7-15/h1,6-9,17H,10-11H2,2-4H3,(H,24,29)/t17-/m0/s1 |
| Peso molecular | 437.95 |
| Reaxy-Rn | 47147131 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=47147131&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
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View spec sheet →Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 I2220496 | Certificate of Analysis | Jul 21, 2025 | J287625 |
| I2220497 | Certificate of Analysis | Jul 21, 2025 | J287625 |
| I2220498 | Certificate of Analysis | Jul 21, 2025 | J287625 |
| I2220499 | Certificate of Analysis | Jul 21, 2025 | J287625 |
| I2220500 | Certificate of Analysis | Jul 21, 2025 | J287625 |
| I2220512 | Certificate of Analysis | Jul 11, 2022 | J287625 |
| I2220522 | Certificate of Analysis | Jul 11, 2022 | J287625 |
| I2220523 | Certificate of Analysis | Jul 11, 2022 | J287625 |
| I2220524 | Certificate of Analysis | Jul 11, 2022 | J287625 |
| I2220525 | Certificate of Analysis | Jul 11, 2022 | J287625 |
| I2220526 | Certificate of Analysis | Jul 11, 2022 | J287625 |
| Solubilidad | Solvent:DMSO, Max Conc. mg/mL: 43.8, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 43.8, Max Conc. mM: 100 |
|---|---|
| Peso molecular | 437.900 g/mol |
| XLogP3 | 3.400 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 437.108 Da |
| Monoisotopic Mass | 437.108 Da |
| Topological Polar Surface Area | 100.000 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 730.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| 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 |
