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· · COA & SDS available for every product · Same-day shipping on in-stock items 1,3-Dipropylxanthine - Moligand™ , Antagonist of A 2A receptor;Antagonist of A 2B receptor, CAS No.31542-62-8, Antagonist of A 2A receptor;Antagonist of A 2B receptor
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. Synonyms
BDBM82032 | AKOS016004647 | Calcium chloride, anhydrous, free-flowing, Redi-Dri(TM), ACS reagent, >=96% | PDSP2_000326 | 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dipropyl- | J-018455 | GTPL427 | MJVIGUCNSRXAFO-UHFFFAOYSA-N | 1,3-dipropyl-3,7-dihydro-1h-purine
Shipped In
Ice chest + Ice pads
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Why this grade Moligand™ Moligand™ 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.
Overview 1,3-Dipropylxanthine is a caffeine analog and phosphodiesterase inhibitor that has some selectivity for A2 adenosine receptors.
Specifications Synonyms
BDBM82032 | AKOS016004647 | Calcium chloride, anhydrous, free-flowing, Redi-Dri(TM), ACS reagent, >=96% | PDSP2_000326 | 1H-Purine-2, 6-dione, 3, 7-dihydro-1, 3-dipropyl- | J-018455 | GTPL427 | MJVIGUCNSRXAFO-UHFFFAOYSA-N | 1, 3-dipropyl-3, 7-dihydro-1h-purine
Specifications & Purity
Moligand™
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Mechanism of action
Antagonist of A 2A receptor;Antagonist of A 2B receptor
Names and Identifiers Canonical Smiles CCCN1C2=C(C(=O)N(C1=O)CCC)NC=N2 IUPAC Name 1,3-dipropyl-7H-purine-2,6-dione InChIKey MJVIGUCNSRXAFO-UHFFFAOYSA-N INCHI 1S/C11H16N4O2/c1-3-5-14-9-8(12-7-13-9)10(16)15(6-4-2)11(14)17/h7H,3-6H2,1-2H3,(H,12,13) Isomeric SMILES CCCN1C2=C(C(=O)N(C1=O)CCC)NC=N2 Molecular Weight 236.27 Reaxy-Rn 253265 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=253265&ln=
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 Organoheterocyclic compounds Class Imidazopyrimidines Subclass Purines and purine derivatives Intermediate Tree Nodes Not available Direct Parent Xanthines Alternative Parents 6-oxopurines Alkaloids and derivatives Pyrimidones Vinylogous amides Imidazoles Heteroaromatic compounds Ureas Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Xanthine - 6-oxopurine - Purinone - Alkaloid or derivatives - Pyrimidone - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Lactam - Urea - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as xanthines. These are purine derivatives with a ketone group conjugated at carbons 2 and 6 of the purine moiety. 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 Soluble in Chloroform, Dichloromethane, DMF, Ethyl Acetate and Methanol Melt Point(°C) 204-206°C (lit.) Molecular Weight 236.270 g/mol XLogP3 1.900 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 4 Exact Mass 236.127 Da Monoisotopic Mass 236.127 Da Topological Polar Surface Area 69.300 Ų Heavy Atom Count 17 Formal Charge 0 Complexity 321.000 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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