1391041-94-3

Basic information

• Product Name: 6,6-dimethyl-2-(2,4,6-trichlorophenylimino)-6,7-dihydrobenzo[d][1,3]oxathiol-4(5H)-one
• Synonyms: 6,6-dimethyl-2-(2,4,6-trichlorophenylimino)-6,7-dihydrobenzo[d][1,3]oxathiol-4(5H)-one
• CAS NO: 1391041-94-3
• Molecular Weight: 376.691
• Mol File: 1391041-94-3.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 6,6-dimethyl-2-(2,4,6-trichlorophenylimino)-6,7-dihydrobenzo[d][1,3]oxathiol-4(5H)-one(CAS DataBase Reference)
• NIST Chemistry Reference: 6,6-dimethyl-2-(2,4,6-trichlorophenylimino)-6,7-dihydrobenzo[d][1,3]oxathiol-4(5H)-one(1391041-94-3)
• EPA Substance Registry System: 6,6-dimethyl-2-(2,4,6-trichlorophenylimino)-6,7-dihydrobenzo[d][1,3]oxathiol-4(5H)-one(1391041-94-3)

Safety Data

• Hazardous Substances Data: 1391041-94-3(Hazardous Substances Data)

Upstream product

• 35024-12-5 (4,4-dimethyl-2,6-dioxo-cyclohexyl)-phenyl-iodonium betaine 
• 22134-07-2 1,3,5-trichloro-2-isothiocyanatobenzene 

Relevant articles and documents

Study on anti-proliferative effect of benzoxathiole derivatives through inactivation of NF-κB in human cancer cells

To investigate the anti-proliferative effect of a newly discovered NF-kB inhibitor, 6,6-dimethyl-2-(phenylimino)-6,7-dihydrobenzo[d][1,3]oxathiol-4(5H)- one (1a), a series of its analogs (1b-n) were prepared and evaluated for their NF-κB inhibition and anti-proliferative activity against various human cancer cell lines. Slight variation of hydrophobicity by replacement of dimethyl group of 1a at 6-position with bulky isopropyl group and introduction of para-fluoro substitution on 2-phenyl group showed good NF-κB inhibitory activity and anti-proliferative activity. However, excessive increase in hydrophobicity with 2,4,6-trichloro substituents on phenyl group resulted in the loss of both the activities. From the SAR results, 2-phenylimino-6,7- dihydrobenzo[d][1,3]oxathiol-4(5H)-one was identified as the lead scaffold for investigating new anticancer agent through inactivation of NF-κB.