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· · COA & SDS available for every product · Same-day shipping on in-stock items A 425619 - Moligand™, ≥95% , Channel blocker of TRPV1, CAS No.581809-67-8, Channel blocker of TRPV1
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. ≥95% Synonyms
1-(4-(trifluoromethyl)benzyl)-3-(isoquinolin-5-yl)urea | 1-isoquinolin-5-yl-3-[[4-(trifluoromethyl)phenyl]methyl]urea | 1-isoquinolin-5-yl-3-(4-trifluoromethyl-benzyl)-urea | N-(5-isoquinolinyl)-N'-[4-(trifluoromethyl)benzyl]urea
Shipped In
Ice chest + Ice pads
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Why this grade Moligand™, ≥95% 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
A-425619, a potent and selective TRPV1 receptor antagonist, is effective in alleviating acute and chronic inflammatory pain and postoperative pain.
Specifications Synonyms
1-(4-(trifluoromethyl)benzyl)-3-(isoquinolin-5-yl)urea | 1-isoquinolin-5-yl-3-[[4-(trifluoromethyl)phenyl]methyl]urea | 1-isoquinolin-5-yl-3-(4-trifluoromethyl-benzyl)-urea | N-(5-isoquinolinyl)-N'-[4-(trifluoromethyl)benzyl]urea
Specifications & Purity
Moligand™, ≥95%
Biochemical and Physiological Mechanisms
Potent TRPV1 antagonist (IC50= 3-9 nM). Blocks capsaicin-evoked currents in rat DRG neurons and inhibits TRPV1-activation byanandamide and N-arachidonoyl-dopamine. Reduces pain in inflammatory, postoperative and osteoarthriticin vivopain models.
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
CHANNEL BLOCKER
Mechanism of action
Channel blocker of TRPV1
Names and Identifiers Canonical Smiles C1=CC2=C(C=CN=C2)C(=C1)NC(=O)NCC3=CC=C(C=C3)C(F)(F)F IUPAC Name 1-isoquinolin-5-yl-3-[[4-(trifluoromethyl)phenyl]methyl]urea InChIKey SJGVXVZUSQLLJB-UHFFFAOYSA-N INCHI 1S/C18H14F3N3O/c19-18(20,21)14-6-4-12(5-7-14)10-23-17(25)24-16-3-1-2-13-11-22-9-8-15(13)16/h1-9,11H,10H2,(H2,23,24,25) Isomeric SMILES C1=CC2=C(C=CN=C2)C(=C1)NC(=O)NCC3=CC=C(C=C3)C(F)(F)F Molecular Weight 345.32 Reaxy-Rn 9719763 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9719763&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 Isoquinolines and derivatives Subclass Not available Intermediate Tree Nodes Not available Direct Parent Isoquinolines and derivatives Alternative Parents Trifluoromethylbenzenes Pyridines and derivatives Heteroaromatic compounds Ureas Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Molecular Framework Aromatic heteropolycyclic compounds Substituents Isoquinoline - Trifluoromethylbenzene - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Urea - Azacycle - Alkyl halide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Carbonyl group - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine. 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: 34.53, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 34.53, Max Conc. mM: 100 Molecular Weight 345.300 g/mol XLogP3 3.500 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 3 Exact Mass 345.109 Da Monoisotopic Mass 345.109 Da Topological Polar Surface Area 54.000 Ų Heavy Atom Count 25 Formal Charge 0 Complexity 449.000 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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