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· · COA & SDS available for every product · Same-day shipping on in-stock items A 582941 - ≥98%(HPLC) , CAS No.848591-90-2
Synonyms
(3aS,6aR)-2-methyl-5-(6-phenylpyridazin-3-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole | a-582491 | Z1900765470 | A 582941 | A-582941 free base | 3-[(3aR,6aS)-5-methyl-octahydropyrrolo[3,4-c]pyrrol-2-yl]-6-phenylpyridazine | Q27254996 | (3aR,6aS)-2-me
Shipped In
Ice chest + Ice pads
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Why this grade ≥98%(HPLC) 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.
Specifications Synonyms
(3aS, 6aR)-2-methyl-5-(6-phenylpyridazin-3-yl)-1, 3, 3a, 4, 6, 6a-hexahydropyrrolo[3, 4-c]pyrrole | a-582491 | Z1900765470 | A 582941 | A-582941 free base | 3-[(3aR, 6aS)-5-methyl-octahydropyrrolo[3, 4-c]pyrrol-2-yl]-6-phenylpyridazine | Q27254996 | (3aR, 6aS)-2-me
Specifications & Purity
≥98%(HPLC)
Biochemical and Physiological Mechanisms
Selectiveα7 nAChR partial agonist; exhibits high affinity for both rat and humanα7 receptors (Kivalues are 10.8 and 16.7 nM respectively). Displays ~15-fold selectivity forα7 over 5-HT3receptors (Ki= 150 nM for 5-HT3).
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles CN1CC2CN(CC2C1)C3=NN=C(C=C3)C4=CC=CC=C4 IUPAC Name (3aR,6aS)-2-methyl-5-(6-phenylpyridazin-3-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole InChIKey GTMRUYCIJSNXGB-GASCZTMLSA-N INCHI 1S/C17H20N4/c1-20-9-14-11-21(12-15(14)10-20)17-8-7-16(18-19-17)13-5-3-2-4-6-13/h2-8,14-15H,9-12H2,1H3/t14-,15+ Isomeric SMILES CN1C[C@@H]2CN(C[C@@H]2C1)C3=NN=C(C=C3)C4=CC=CC=C4 Molecular Weight 280.37 Reaxy-Rn 11120522 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11120522&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 Diazines Subclass Pyridazines and derivatives Intermediate Tree Nodes Not available Direct Parent Phenylpyridazines Alternative Parents Dialkylarylamines Aminopyridazines N-alkylpyrrolidines Imidolactams Benzene and substituted derivatives Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Phenylpyridazine - Dialkylarylamine - Aminopyridazine - Monocyclic benzene moiety - Imidolactam - Benzenoid - N-alkylpyrrolidine - Heteroaromatic compound - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as phenylpyridazines. These are organic compounds containing a pyridazine ring substituted by a phenyl group. 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 Solvent:DMSO, Max Conc. mg/mL: 28.04, Max Conc. mM: 100; Solvent:1eq. HCl, Max Conc. mg/mL: 14.02, Max Conc. mM: 50 Molecular Weight 280.370 g/mol XLogP3 2.100 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 2 Exact Mass 280.169 Da Monoisotopic Mass 280.169 Da Topological Polar Surface Area 32.299 Ų Heavy Atom Count 21 Formal Charge 0 Complexity 341.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 2 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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