CAS 99473-15-1

(5E)-2,2-Dimethyl-7-[(1-naphthalenylmethyl)amino]-5-hepten-3-ynoic acid

Description:

(5E)-2,2-Dimethyl-7-[(1-naphthalenylmethyl)amino]-5-hepten-3-ynoic acid, with the CAS number 99473-15-1, is a chemical compound characterized by its complex structure, which includes a heptenynoic acid backbone. This compound features a conjugated system due to the presence of both a double bond and a triple bond, contributing to its reactivity and potential biological activity. The presence of a naphthalenylmethyl group suggests that it may exhibit aromatic properties, which can influence its interactions in biological systems. The dimethyl substitution at the second carbon enhances steric hindrance, potentially affecting its conformation and reactivity. As an amino acid derivative, it may participate in various biochemical pathways, possibly acting as a ligand or a precursor in synthetic organic chemistry. Its unique structure may also confer specific pharmacological properties, making it of interest in medicinal chemistry. However, detailed studies would be necessary to fully elucidate its properties and potential applications.

Formula: C₂₀H₂₁NO₂

InChI: InChI=1S/C20H21NO2/c1-20(2,19(22)23)13-6-3-7-14-21-15-17-11-8-10-16-9-4-5-12-18(16)17/h3-5,7-12,21H,14-15H2,1-2H3,(H,22,23)/b7-3+

InChI key: InChIKey=HLMXKUJHRUTHIL-XVNBXDOJSA-N

SMILES: C(NC/C=C/C#CC(C(O)=O)(C)C)C=1C2=C(C=CC1)C=CC=C2

Synonyms:

• 5-Hepten-3-ynoic acid, 2,2-dimethyl-7-[(1-naphthalenylmethyl)amino]-, (5E)-
• 5-Hepten-3-ynoic acid, 2,2-dimethyl-7-[(1-naphthalenylmethyl)amino]-, (E)-
• (5E)-2,2-Dimethyl-7-[(1-naphthalenylmethyl)amino]-5-hepten-3-ynoic acid
• N-Desmethylcarboxyterbinafine

Terbinafine Impurity 5

CAS: 99473-15-1

Formula: C₂₀H₂₁NO₂

Molecular weight: 307.39

Ref: 4Z-T-5421

N-Desmethylcarboxy Terbinafine

CAS: 99473-15-1

Formula: C₂₀H₂₁NO₂

Color and Shape: Neat

Molecular weight: 307.39

Ref: TR-D291405

(5E)-2,2-Dimethyl-7-[(1-naphthalenylmethyl)amino]-5-hepten-3-ynoic acid

CAS: 99473-15-1

The compound (5E)-2,2-dimethyl-7-[(1-naphthalenylmethyl)amino]-5-hepten-3-ynoic acid is a chiral antifungal agent. It was developed to be used as an analytical tool for the determination of plasma concentrations and it can be used in profiling and chiral chromatography. This compound has been shown to have excellent solubility in water and good stability in most organic solvents. The compound is metabolized by the liver and excreted via the kidneys, with a half life of approximately 6 hours. The compound also shows linearity over a wide concentration range, which makes it useful for measuring quantitative changes in plasma concentrations.

Formula: C₂₀H₂₁NO₂

Purity: Min. 95%

Molecular weight: 307.39 g/mol

Ref: 3D-ID21358