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· · COA & SDS available for every product · Same-day shipping on in-stock items GW7845 - Moligand™ , Agonist of Peroxisome proliferator-activated receptor-γ, CAS No.196809-22-0, Agonist of Peroxisome proliferator-activated receptor-γ
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
2-((S)-1-Carboxy-2-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-phenyl}-ethylamino)-benzoic acid methyl ester | N-(2-(METHOXYCARBONYL)PHENYL)-O-(2-(5-METHYL-2-PHENYL-4-OXAZOLYL)ETHYL)-L-TYROSINE | (2S)-2-(2-methoxycarbonylanilino)-3-[4-[2-(5-methyl-2-phe
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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 Synonyms
2-((S)-1-Carboxy-2-{4-[2-(5-methyl-2-phenyl-oxazol-4-yl)-ethoxy]-phenyl}-ethylamino)-benzoic acid methyl ester | N-(2-(METHOXYCARBONYL)PHENYL)-O-(2-(5-METHYL-2-PHENYL-4-OXAZOLYL)ETHYL)-L-TYROSINE | (2S)-2-(2-methoxycarbonylanilino)-3-[4-[2-(5-methyl-2-phe
Specifications & Purity
Moligand™
Mechanism of action
Agonist of Peroxisome proliferator-activated receptor-γ
Names and Identifiers Canonical Smiles COC(=O)c1ccccc1N[C@H](C(=O)O)Cc1ccc(cc1)OCCc1nc(oc1C)c1ccccc1 IUPAC Name (2S)-2-[(2-methoxycarbonylphenyl)amino]-3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanoic acid InChIKey KEGOAFNIGUBYHZ-SANMLTNESA-N INCHI 1S/C29H28N2O6/c1-19-24(31-27(37-19)21-8-4-3-5-9-21)16-17-36-22-14-12-20(13-15-22)18-26(28(32)33)30-25-11-7-6-10-23(25)29(34)35-2/h3-15,26,30H,16-18H2,1-2H3,(H,32,33)/t26-/m0/s1 Isomeric SMILES CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=CC=C(C=C3)C[C@@H](C(=O)O)NC4=CC=CC=C4C(=O)OC PubChem CID 9870584
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 Organic acids and derivatives Class Carboxylic acids and derivatives Subclass Amino acids, peptides, and analogues Intermediate Tree Nodes Amino acids and derivatives - Alpha amino acids and derivatives Direct Parent Phenylalanine and derivatives Alternative Parents Phenylpropanoic acids Phenyl-1,3-oxazoles Benzoic acid esters Amphetamines and derivatives Aminobenzoic acids and derivatives L-alpha-amino acids Benzoyl derivatives Phenylalkylamines Phenoxy compounds Phenol ethers 2,4,5-trisubstituted oxazoles Aniline and substituted anilines Secondary alkylarylamines Alkyl aryl ethers Vinylogous amides Heteroaromatic compounds Methyl esters Amino acids Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Phenylalanine or derivatives - 3-phenylpropanoic-acid - Phenyl-1,3-oxazole - Alpha-amino acid - Aminobenzoic acid or derivatives - Amphetamine or derivatives - Benzoate ester - L-alpha-amino acid - Benzoic acid or derivatives - Phenoxy compound - 2,4,5-trisubstituted 1,3-oxazole - Phenylalkylamine - Aniline or substituted anilines - Benzoyl - Phenol ether - Alkyl aryl ether - Aralkylamine - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Methyl ester - Heteroaromatic compound - Vinylogous amide - Oxazole - Azole - Amino acid - Carboxylic acid ester - Secondary amine - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Ether - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. 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 Molecular Weight 500.500 g/mol XLogP3 6.300 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 8 Rotatable Bond Count 12 Exact Mass 500.195 Da Monoisotopic Mass 500.195 Da Topological Polar Surface Area 111.000 Ų Heavy Atom Count 37 Formal Charge 0 Complexity 721.000 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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