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· · COA & SDS available for every product · Same-day shipping on in-stock items MRS1067 - Moligand™ , Antagonist of A 3 receptor, CAS No.70460-45-6, Antagonist of A 3 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
SCHEMBL2962179 | 3,6-Dichloro-2-(2-isopropoxy-4-methyl-phenyl)-chromen-4-one | 3,6-dichloro-2'-(isopropoxy)-4'-methylflavone | PDSP2_000262 | 3,6-dichloro-2'-isopropyloxy-4'-methylflavone | 3,6-dichloro-2-(4-methyl-2-propan-2-yloxyphenyl)chromen-4-one | Q
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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 Room temperature Ships 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
SCHEMBL2962179 | 3, 6-Dichloro-2-(2-isopropoxy-4-methyl-phenyl)-chromen-4-one | 3, 6-dichloro-2'-(isopropoxy)-4'-methylflavone | PDSP2_000262 | 3, 6-dichloro-2'-isopropyloxy-4'-methylflavone | 3, 6-dichloro-2-(4-methyl-2-propan-2-yloxyphenyl)chromen-4-one | Q
Specifications & Purity
Moligand™
Mechanism of action
Antagonist of A 3 receptor
Names and Identifiers Canonical Smiles CC(Oc1cc(C)ccc1c1oc2ccc(cc2c(=O)c1Cl)Cl)C IUPAC Name 3,6-dichloro-2-(4-methyl-2-propan-2-yloxyphenyl)chromen-4-one InChIKey PWGZOUCWGRTPSM-UHFFFAOYSA-N INCHI 1S/C19H16Cl2O3/c1-10(2)23-16-8-11(3)4-6-13(16)19-17(21)18(22)14-9-12(20)5-7-15(14)24-19/h4-10H,1-3H3 Isomeric SMILES CC1=CC(=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)Cl)OC(C)C PubChem CID 252716
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 Phenylpropanoids and polyketides Class Flavonoids Subclass Flavones Intermediate Tree Nodes Not available Direct Parent Flavones Alternative Parents Chromones Phenoxy compounds Phenol ethers Toluenes Pyranones and derivatives Alkyl aryl ethers Aryl chlorides Heteroaromatic compounds Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Flavone - Chromone - Benzopyran - 1-benzopyran - Phenoxy compound - Phenol ether - Alkyl aryl ether - Pyranone - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyran - Heteroaromatic compound - Ether - Organoheterocyclic compound - Oxacycle - Organochloride - Organohalogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as flavones. These are flavonoids with a structure based on the backbone of 2-phenylchromen-4-one (2-phenyl-1-benzopyran-4-one). 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) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 363.200 g/mol XLogP3 5.800 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 362.048 Da Monoisotopic Mass 362.048 Da Topological Polar Surface Area 35.500 Ų Heavy Atom Count 24 Formal Charge 0 Complexity 517.000 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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