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· · COA & SDS available for every product · Same-day shipping on in-stock items DH 97 - Moligand™ , Antagonist of MT 2 receptor, CAS No.220339-00-4, Antagonist of MT 2 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
N-pentanoyl 2-benzyltryptamine | Q27077041 | HMS3267D11 | Pentanoic acid [2-(2-benzyl-1H-indol-3-yl)-ethyl]-amide | DTXSID90392749 | BRD-K06014311-001-01-2 | SR-01000597373 | NCGC00025049-01 | N-(2-(2-Benzyl-1H-indol-3-yl)ethyl)pentanamide | J-019556 | HM
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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 Normal 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
N-pentanoyl 2-benzyltryptamine | Q27077041 | HMS3267D11 | Pentanoic acid [2-(2-benzyl-1H-indol-3-yl)-ethyl]-amide | DTXSID90392749 | BRD-K06014311-001-01-2 | SR-01000597373 | NCGC00025049-01 | N-(2-(2-Benzyl-1H-indol-3-yl)ethyl)pentanamide | J-019556 | HM
Specifications & Purity
Moligand™
Biochemical and Physiological Mechanisms
A relatively potent MT2melatonin receptor antagonist (pKivalue = 8.03), displaying 89- and 229-fold selectivity over MT1and GPR50 (melatonin-related orphan receptor) respectively.
Mechanism of action
Antagonist of MT 2 receptor
Names and Identifiers Canonical Smiles CCCCC(=O)NCCC1=C(NC2=CC=CC=C21)CC3=CC=CC=C3 IUPAC Name N-[2-(2-benzyl-1H-indol-3-yl)ethyl]pentanamide InChIKey HDOIPCLEKCEANF-UHFFFAOYSA-N INCHI 1S/C22H26N2O/c1-2-3-13-22(25)23-15-14-19-18-11-7-8-12-20(18)24-21(19)16-17-9-5-4-6-10-17/h4-12,24H,2-3,13-16H2,1H3,(H,23,25) Isomeric SMILES CCCCC(=O)NCCC1=C(NC2=CC=CC=C21)CC3=CC=CC=C3 Molecular Weight 334.46 Reaxy-Rn 8578185 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8578185&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 Indoles and derivatives Subclass Indoles Intermediate Tree Nodes Not available Direct Parent 3-alkylindoles Alternative Parents Substituted pyrroles N-acyl amines Benzene and substituted derivatives Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteropolycyclic compounds Substituents 3-alkylindole - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Substituted pyrrole - Benzenoid - Fatty acyl - Pyrrole - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position. 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: None, Max Conc. mM: 100 Molecular Weight 334.500 g/mol XLogP3 4.900 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 8 Exact Mass 334.205 Da Monoisotopic Mass 334.205 Da Topological Polar Surface Area 44.900 Ų Heavy Atom Count 25 Formal Charge 0 Complexity 405.000 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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