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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items LY2389575 - Moligand™ , Allosteric modulator of mGlu 3 receptor, CAS No.L611638, Allosteric modulator of mGlu 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
LY 2389575;LY-2389575
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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 Sinónimos
LY 2389575;LY-2389575
Especificaciones y pureza
Moligand™
Condiciones de almacenamiento de almacenamiento
Room temperature
Tipo de acción
ALLOSTERIC MODULATOR
Mecanismo de acción
Allosteric modulator of mGlu 3 receptor
Nombres e identificadores Sonrisas canónicas
Clc1ccc(c(c1)Cl)CN[C@H]1CCN(C1)c1ncc(cn1)Br
IUPAC Name
(3S)-1-(5-bromopyrimidin-2-yl)-N-[(2,4-dichlorophenyl)methyl]pyrrolidin-3-amine
InChIKey
PXQNLQLMRMROSB-ZDUSSCGKSA-N
INCHI
1S/C15H15BrCl2N4/c16-11-7-20-15(21-8-11)22-4-3-13(9-22)19-6-10-1-2-12(17)5-14(10)18/h1-2,5,7-8,13,19H,3-4,6,9H2/t13-/m0/s1
Isómeros SMILES
C1CN(C[C@H]1NCC2=C(C=C(C=C2)Cl)Cl)C3=NC=C(C=N3)Br
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 Clase Benzene and substituted derivatives Subclass Halobenzenes Intermediate Tree Nodes Chlorobenzenes Direct Parent Dichlorobenzenes Alternative Parents Phenylmethylamines Dialkylarylamines Benzylamines Halopyrimidines Aralkylamines Aminopyrimidines and derivatives Aryl chlorides Aryl bromides Pyrrolidines Heteroaromatic compounds Dialkylamines Azacyclic compounds Organochlorides Organobromides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Dialkylarylamine - Benzylamine - Phenylmethylamine - 1,3-dichlorobenzene - Aminopyrimidine - Aralkylamine - Halopyrimidine - Aryl bromide - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Pyrrolidine - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organonitrogen compound - Organochloride - Organohalogen compound - Organobromide - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it. 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.
Estructura 3D Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 402.100 g/mol XLogP3 3.900 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 4 Exact Mass 399.986 Da Monoisotopic Mass 399.986 Da Topological Polar Surface Area 41.100 Ų Heavy Atom Count 22 Formal Charge 0 Complexity 354.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 1 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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