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· · COA & SDS available for every product · Same-day shipping on in-stock items RP 67580 - Moligand™, ≥97%(HPLC) , Antagonist of NK 1 receptor, CAS No.135911-02-3, Antagonist of NK 1 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. ≥97%(HPLC) Synonyms
SR-01000597596 | PDSP2_000649 | 7,7-Diphenyl-2-(1-imino-2-(2-methoxyphenyl)ethyl)perhydroisoindol-4-one | SR-01000597596-1 | DTXSID30929179 | J-006783 | NCGC00025240-01 | RP 67580 | VWBOQFANCXZMAU-LOSJGSFVSA-N | (3ar,7ar)-7,7-diphenyl-2-[1-imino-2-(2-meth
Shipped In
Ice chest + Ice pads
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Why this grade Moligand™, ≥97%(HPLC) 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.
Specifications Synonyms
SR-01000597596 | PDSP2_000649 | 7, 7-Diphenyl-2-(1-imino-2-(2-methoxyphenyl)ethyl)perhydroisoindol-4-one | SR-01000597596-1 | DTXSID30929179 | J-006783 | NCGC00025240-01 | RP 67580 | VWBOQFANCXZMAU-LOSJGSFVSA-N | (3ar, 7ar)-7, 7-diphenyl-2-[1-imino-2-(2-meth
Specifications & Purity
Moligand™, ≥97%(HPLC)
Biochemical and Physiological Mechanisms
Potent and selective tachykinin NK1receptor antagonist (Kivalues are 2.9 nM and > 10μM for rat NK1, and rat NK2and NK3receptors respectively). Displays higher affinity at rat and mouse than human receptors. Antinociceptivein vivo, possibly partly via inhi
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 NK 1 receptor
Names and Identifiers Canonical Smiles COC1=CC=CC=C1CC(=N)N2CC3C(C2)C(CCC3=O)(C4=CC=CC=C4)C5=CC=CC=C5 IUPAC Name (3aR,7aR)-2-[2-(2-methoxyphenyl)ethanimidoyl]-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-4-one InChIKey VWBOQFANCXZMAU-LOSJGSFVSA-N INCHI 1S/C29H30N2O2/c1-33-27-15-9-8-10-21(27)18-28(30)31-19-24-25(20-31)29(17-16-26(24)32,22-11-4-2-5-12-22)23-13-6-3-7-14-23/h2-15,24-25,30H,16-20H2,1H3/t24-,25+/m0/s1 Isomeric SMILES COC1=CC=CC=C1CC(=N)N2C[C@H]3[C@@H](C2)C(CCC3=O)(C4=CC=CC=C4)C5=CC=CC=C5 PubChem CID 107686 Molecular Weight 438.57
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 Benzenoids Class Benzene and substituted derivatives Subclass Diphenylmethanes Intermediate Tree Nodes Not available Direct Parent Diphenylmethanes Alternative Parents Isoindolones Isoindoles Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Pyrrolidines Ketones Carboximidamides Carboxamidines Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Diphenylmethane - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyrrolidine - Ketone - Carboximidamide - Azacycle - Organoheterocyclic compound - Carboxylic acid amidine - Ether - Amidine - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups. 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:ethanol, Max Conc. mg/mL: 43.86, Max Conc. mM: 100; Solvent:DMSO, Max Conc. mg/mL: 21.93, Max Conc. mM: 50 Molecular Weight 438.600 g/mol XLogP3 4.700 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 6 Exact Mass 438.231 Da Monoisotopic Mass 438.231 Da Topological Polar Surface Area 53.400 Ų Heavy Atom Count 33 Formal Charge 0 Complexity 676.000 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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