CAS 915945-40-3

4-[(3-Chloro-4-fluorophenyl)amino]-6-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-7-ethoxy-3-quinolinecarbonitrile

Description:

The chemical substance known as 4-[(3-Chloro-4-fluorophenyl)amino]-6-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-7-ethoxy-3-quinolinecarbonitrile, with the CAS number 915945-40-3, is a synthetic organic compound characterized by its complex molecular structure. It features a quinoline core, which is a bicyclic aromatic compound known for its diverse biological activities. The presence of a cyano group (carbonitrile) and various substituents, including a chloro and a fluoro group, suggests potential for significant reactivity and interaction with biological targets. The ethoxy group enhances its solubility and may influence its pharmacokinetic properties. This compound is likely to exhibit properties typical of quinoline derivatives, such as antimicrobial, antitumor, or anti-inflammatory activities, making it of interest in medicinal chemistry. Its specific characteristics, including melting point, solubility, and spectral data, would require empirical determination through experimental methods. Overall, this compound represents a class of molecules that could be explored for therapeutic applications.

Formula: C₂₆H₁₆ClFN₄O₃

InChI: InChI=1S/C26H16ClFN4O3/c1-2-35-23-11-21-18(10-22(23)32-25(33)16-5-3-4-6-17(16)26(32)34)24(14(12-29)13-30-21)31-15-7-8-20(28)19(27)9-15/h3-11,13H,2H2,1H3,(H,30,31)

InChI key: InChIKey=RFLMKSNVALOHCZ-UHFFFAOYSA-N

SMILES: O(CC)C=1C(=CC2=C(C1)N=CC(C#N)=C2NC3=CC(Cl)=C(F)C=C3)N4C(=O)C=5C(C4=O)=CC=CC5

Synonyms:

• 3-Quinolinecarbonitrile, 4-[(3-chloro-4-fluorophenyl)amino]-6-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-7-ethoxy-
• 3-Cyano-4-(3-chloro-4-fluoroanilino)-7-ethoxy-6-(phthalimidyl)quinoline
• 4-[(3-Chloro-4-fluorophenyl)amino]-6-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-7-ethoxy-3-quinolinecarbonitrile

3-Cyano-4-(3-chloro-4-fluoroanilino)-7-ethoxy-6-(phthalimidyl)quinoline

Controlled Product

CAS: 915945-40-3

Applications Intermediate in the preparation of Tyrosine Kinase Inhibitors.

Formula: C₂₆H₁₆ClFN₄O₃

Color and Shape: Neat

Molecular weight: 486.88

Ref: TR-C962400