1289514-30-2

Basic information

• Product Name: 4-(3-ethoxy-4-hydroxyphenyl)-6-(1,2,3,4-tetrahydronaphthalen-6-yl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile
• Synonyms: 4-(3-ethoxy-4-hydroxyphenyl)-6-(1,2,3,4-tetrahydronaphthalen-6-yl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile
• CAS NO: 1289514-30-2
• Molecular Weight: 402.517
• Mol File: 1289514-30-2.mol
• Article Data: 2

Chemical Properties

• CAS DataBase Reference: 4-(3-ethoxy-4-hydroxyphenyl)-6-(1,2,3,4-tetrahydronaphthalen-6-yl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 4-(3-ethoxy-4-hydroxyphenyl)-6-(1,2,3,4-tetrahydronaphthalen-6-yl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile(1289514-30-2)
• EPA Substance Registry System: 4-(3-ethoxy-4-hydroxyphenyl)-6-(1,2,3,4-tetrahydronaphthalen-6-yl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile(1289514-30-2)

Safety Data

• Hazardous Substances Data: 1289514-30-2(Hazardous Substances Data)

Upstream product

• 121-32-4 4-hydroxy-3-ethoxybenzaldehyde 
• 774-55-0 6-Acetyl-1,2,3,4-tetrahydronaphthalene 
• 7357-70-2 Cyanothioacetamide 

Downstream Products

• 1384872-98-3 4-(3-ethoxy-4-hydroxyphenyl)-6-(1,2,3,4-tetrahydronaphthalen-6-yl)-2-(2,3,4,6-tetra-O-acetyl-β-D-galactopyranosylthio)pyridine-3-carbonitrile 
• 1384872-96-1 4-(3-ethoxy-4-hydroxyphenyl)-6-(1,2,3,4-tetrahydronaphthalen-6-yl)-2-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosylthio)pyridine-3-carbonitrile 

Relevant articles and documents

Synthesis, molecular docking and preliminary in-Vitro cytotoxic evaluation of some substituted tetrahydronaphthalene (2',3',4',6'-tetra-O-acetyl-β-D- gluco-/galactopyranosyl) derivatives

A facile, convenient and high yielding synthesis of novel S-glycosides and N-glycosides incorporating 1,2,3,4-tetrahydronaphthalene and or 1,2-dihydropyridines moieties has been described. The aglycons 2, 4, and 7 were coupled with different activated halosugars in the presence of basic and acidic medium. The preliminary in-vitro cytotoxic evaluation revealed that compounds 3c, 3f, 5c and 7b show promising activity. A molecular docking study was performed against tyrosine kinase (TK) (PDB code: 1t46) by Autodock Vina. The docking output was analyzed and some compounds have shown hydrogen bond (H-B) formation with reasonable distances ranged from 2.06 A to 3.06 A with Thr 670 and Cys 673 residues found in the specified pocket. No hydrogen bond was observed with either Glu 640 nor Asp 810 residues, as was expected from pdbsum.