Determine the necessary mass, volume, or concentration for preparing a solution.
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Moligand™, ≥96% Moligand™ 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.
| ALogP | 0.9 |
|---|
| Pubchem Sid | 504769917 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504769917 |
| Sonrisas canónicas | CN1C2=C(C(=C(C1=O)F)NC3=C(C=C(C=C3)I)F)C(=O)N(C=N2)CC(CO)O |
| IUPAC Name | 3-[(2R)-2,3-dihydroxypropyl]-6-fluoro-5-(2-fluoro-4-iodoanilino)-8-methylpyrido[2,3-d]pyrimidine-4,7-dione |
| InChIKey | RCLQNICOARASSR-SECBINFHSA-N |
| INCHI | 1S/C17H15F2IN4O4/c1-23-15-12(16(27)24(7-21-15)5-9(26)6-25)14(13(19)17(23)28)22-11-3-2-8(20)4-10(11)18/h2-4,7,9,22,25-26H,5-6H2,1H3/t9-/m1/s1 |
| Isómeros SMILES | CN1C2=C(C(=C(C1=O)F)NC3=C(C=C(C=C3)I)F)C(=O)N(C=N2)C[C@H](CO)O |
| CAS alternativo | 1035555-63-5 |
| PubChem CID | 24963252 |
| Términos de entrada MeSH | TAK 733;TAK-733;TAK733 |
| Peso molecular | 504.23 |
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 →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Pyridopyrimidines |
| Subclass | Pyrido[2,3-d]pyrimidines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyrido[2,3-d]pyrimidines |
| Alternative Parents | Aniline and substituted anilines Pyrimidones Pyridinones Aminopyridines and derivatives Fluorobenzenes Iodobenzenes Aryl fluorides Aryl iodides Vinylogous amides Heteroaromatic compounds 1,2-diols Secondary alcohols Lactams Secondary amines Azacyclic compounds Primary alcohols Organofluorides Organoiodides Organopnictogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Pyrido[2,3-d]pyrimidine - Aniline or substituted anilines - Aminopyridine - Fluorobenzene - Halobenzene - Iodobenzene - Pyridinone - Pyrimidone - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Pyridine - Pyrimidine - Aryl fluoride - Benzenoid - Vinylogous amide - Heteroaromatic compound - Secondary alcohol - 1,2-diol - Lactam - Secondary amine - Azacycle - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organoiodide - Amine - Alcohol - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as pyrido[2,3-d]pyrimidines. These are compounds containing the pyrido[2,3-d]pyrimidine ring system, which is a pyridopyrimidine isomer with three ring nitrogen atoms at the 1-, 3-, and 8- position. |
| External Descriptors | Not available |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Mar 31, 2026 | T127214 | |
| Certificate of Analysis | Oct 29, 2025 | T127214 | |
| Certificate of Analysis | Oct 29, 2025 | T127214 | |
| Certificate of Analysis | Oct 29, 2025 | T127214 | |
| Certificate of Analysis | Oct 29, 2025 | T127214 | |
| Certificate of Analysis | Oct 29, 2025 | T127214 | |
| Certificate of Analysis | Oct 29, 2025 | T127214 | |
| Certificate of Analysis | Jan 03, 2025 | T127214 |
| Solubilidad | DMSO 101 mg/mL Water <1 mg/mL Ethanol <1 mg/mL |
|---|---|
| Peso molecular | 504.230 g/mol |
| XLogP3 | 0.900 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 504.011 Da |
| Monoisotopic Mass | 504.011 Da |
| Topological Polar Surface Area | 105.000 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 772.000 |
| 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 |
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