469898-10-0

Basic information

• Product Name: 5(4H)-Oxazolone, 4-[(4-bromophenyl)methylene]-2-phenyl-, (4Z)-
• CAS NO: 469898-10-0
• Molecular Formula: C16H10BrNO2
• Molecular Weight: 328.165
• Mol File: 469898-10-0.mol
• Article Data: 17

Chemical Properties

• CAS DataBase Reference: 5(4H)-Oxazolone, 4-[(4-bromophenyl)methylene]-2-phenyl-, (4Z)-(CAS DataBase Reference)
• NIST Chemistry Reference: 5(4H)-Oxazolone, 4-[(4-bromophenyl)methylene]-2-phenyl-, (4Z)-(469898-10-0)
• EPA Substance Registry System: 5(4H)-Oxazolone, 4-[(4-bromophenyl)methylene]-2-phenyl-, (4Z)-(469898-10-0)

Safety Data

• Hazardous Substances Data: 469898-10-0(Hazardous Substances Data)

Upstream product

• 98-88-4 benzoyl chloride 
• 18815-75-3 N-(4-bromobenzyl-1-carbonyl)-glycine 
• 100-52-7 benzaldehyde 
• 495-69-2 Hippuric Acid 
• 1122-91-4 4-bromo-benzaldehyde 

Downstream Products

• 1200450-87-8 (E)-4-(4-bromobenzylidene)-2-phenyloxazol-5(4H)-one 
• 1314387-52-4 bis(2,2,2-trifluoroethyl) (5S,6R,9S)-6-(4-bromophenyl)-4-oxo-2-phenyl-9-vinyl-3-oxa-1-azaspiro[4.4]non-1-ene-7,7-dicarboxylate 

Relevant articles and documents

FLUORESCENT SYSTEMS FOR BIOLOGICAL IMAGING AND USES THEREOF

The invention relates to compounds of formula I, in which Y, Ar1, Ar2, X, R1 and R2 are defined herein, and to their use in a variety of biological imaging techniques and therapeutic methods. In aspects, the invention relates to conjugates comprising the compounds of formula I and their associated uses and therapeutic uses.

Copper nitrate-mediated synthesis of 3-aryl isoxazolines and isoxazoles from olefinic azlactones

A copper nitrate-mediated [2 + 2 + 1] cycloaddition reaction was developed for the expedient synthesis of pharmacologically interesting 3-aryl substituted isoxazolines and isoxazoles through CC bond cleavage. Copper nitrate is employed as a reaction promoter and precursor of nitrile oxides. The given approach features a new mode of cycloaddition from olefinic azlactones, copper nitrate and unsaturated compounds with wide substrate scope, good functional group tolerance and operational simplicity.

Design, synthesis and evaluation of novel phenyl propionamide derivatives as non-nucleoside hepatitis B virus inhibitors

As an ongoing search for potent non-nucleoside anti-HBV agents with novel structures, we described a series of phenyl propionamide derivatives (3a-b, 4a-e, 7a-g, 8a-h and 9a-b) by pharmacophore fusion strategy in the present work. All the compounds exhibited an anti-HBV activity to some extent. Among them, compounds 8d and 9b displayed most potent anti-HBV activity with IC50 values on HBV DNA replication of 0.46 and 0.14 μM, respectively. And the selective index values of 8d and 9b were more than 217.39 and 153.14, suggesting that 8d and 9b exhibited favorable safety profiles. Interestingly, 8d and 9b possessed significantly antiviral activities against lamivudine and entecavir resistant HBV mutants with IC50 values of 0.77 and 0.32 μM. Notably, preliminary anti-HBV action mechanism studies showed that 8d could inhibit intracellular HBV pgRNA and RT activity of the HBV polymerase. Molecular docking studies suggested that compound 8d could fit into the dimer-dimer interface of HBV core protein by hydrophobic interaction. In addition, in silico prediction of physicochemical properties showed that 8d conformed well to the Lipinski's rule of five, suggesting its potential for use as a drug like molecule. Taken together, 8d possessed significantly anti-HBV activity, low toxicity, diverse anti-HBV mechanism and favorable physicochemical properties, and warranted further investigation as a promising non-nucleoside anti-HBV candidate.