≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C,Desiccated Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Highly selective orally active peroxisome proliferator-activated receptor (PPAR)γ agonist (pEC50 values are 8.05, < 4 and < 4 for human PPARγ, PPARα and PPARδ receptors respectively). Decreases glucose, fatty acid and triglyceride levels following oral administration in vivo.
| Canonical Smiles | CN(CCOC1=CC=C(C=C1)CC(C(=O)O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C4=CC=CC=N4.Cl |
|---|---|
| IUPAC Name | (2S)-2-(2-benzoylanilino)-3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoic acid;hydrochloride |
| InChIKey | KXNKIKXTGRMLEY-YCBFMBTMSA-N |
| INCHI | 1S/C30H29N3O4.ClH/c1-33(28-13-7-8-18-31-28)19-20-37-24-16-14-22(15-17-24)21-27(30(35)36)32-26-12-6-5-11-25(26)29(34)23-9-3-2-4-10-23;/h2-18,27,32H,19-21H2,1H3,(H,35,36);1H/t27-;/m0./s1 |
| Isomeric SMILES | CN(CCOC1=CC=C(C=C1)C[C@@H](C(=O)O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C4=CC=CC=N4.Cl |
| Alternate CAS | 196808-24-9 |
| PubChem CID | 56972174 |
| Molecular Weight | 532.03 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| 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 | Benzophenones Aryl-phenylketones Diphenylmethanes Phenylpropanoic acids Amphetamines and derivatives L-alpha-amino acids Benzoyl derivatives Aniline and substituted anilines Dialkylarylamines Phenylalkylamines Phenoxy compounds Phenol ethers Aminopyridines and derivatives Secondary alkylarylamines Alkyl aryl ethers Imidolactams Heteroaromatic compounds Vinylogous amides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organic oxides Hydrochlorides |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Phenylalanine or derivatives - Benzophenone - Diphenylmethane - Aryl-phenylketone - 3-phenylpropanoic-acid - Alpha-amino acid - Amphetamine or derivatives - L-alpha-amino acid - Phenol ether - Aryl ketone - Phenoxy compound - Dialkylarylamine - Benzoyl - Aniline or substituted anilines - Phenylalkylamine - Aralkylamine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Aminopyridine - Pyridine - Benzenoid - Imidolactam - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Amino acid - Ketone - Tertiary amine - Monocarboxylic acid or derivatives - Ether - Organoheterocyclic compound - Carboxylic acid - Azacycle - Secondary amine - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Hydrochloride - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organooxygen compound - Amine - 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 |
| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
|---|
| Solubility | Solvent:ethanol, Max Conc. mg/mL: 49.56, Max Conc. mM: 100 with gentle warming; Solvent:water, Max Conc. mg/mL: 26.6, Max Conc. mM: 50 |
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