221121-65-9

Basic information

• Product Name: 4(1H)-Pyrimidinone, 6-[(2,6-difluorophenyl)methyl]-2,3-dihydro-2-thioxo-
• CAS NO: 221121-65-9
• Molecular Formula: C11H8F2N2OS
• Molecular Weight: 254.26
• Mol File: 221121-65-9.mol
• Article Data: 2

Chemical Properties

• CAS DataBase Reference: 4(1H)-Pyrimidinone, 6-[(2,6-difluorophenyl)methyl]-2,3-dihydro-2-thioxo-(CAS DataBase Reference)
• NIST Chemistry Reference: 4(1H)-Pyrimidinone, 6-[(2,6-difluorophenyl)methyl]-2,3-dihydro-2-thioxo-(221121-65-9)
• EPA Substance Registry System: 4(1H)-Pyrimidinone, 6-[(2,6-difluorophenyl)methyl]-2,3-dihydro-2-thioxo-(221121-65-9)

Safety Data

• Hazardous Substances Data: 221121-65-9(Hazardous Substances Data)

Upstream product

• 221121-33-1 2-(2,6-difluoro-phenyl)-1-imidazol-1-yl-ethanone 
• 17356-08-0 thiourea 
• 221121-46-6 ethyl 4-(2,6-difluorophenyl)-3-oxobutanoate 

Downstream Products

• 221122-02-7 6-(2,6-difluoro-benzyl)-2-isopropylsulfanyl-3H-pyrimidin-4-one 
• 221122-04-9 6-(2,6-difluoro-benzyl)-2-isobutylsulfanyl-3H-pyrimidin-4-one 
• 221122-01-6 6-(2,6-difluorophenylmethyl)-3,4-dihydro-2-methylthiopyrimidin-4(3H)-one 
• 221122-07-2 2-cyclohexylsulfanyl-6-(2,6-difluoro-benzyl)-3H-pyrimidin-4-one 
• 221122-05-0 2-sec-butylsulfanyl-6-(2,6-difluoro-benzyl)-3H-pyrimidin-4-one 
• 221122-06-1 2-cyclopentylthio-6-(2,6-difluorophenylmethyl)-3,4-dihydrogyrimidin-4-(3H)-one 

Relevant articles and documents

Does the 2-methylthiomethyl substituent really confer high anti-HIV-1 activity to S-DABOs?

S-DABO derivatives containing the methylthiomethyl (MTM) group have been synthesized and tested for anti-HIV-1 activity in cell-based assay (MTT and p24 assays) and for their capability to target the HIV-1 reverse transcriptase in enzyme assays. Data of experiments lead to the conclusion that the introduction of a 2-MTM-thio side chain is not sufficient per se to significantly increase S-DABO's potency. Nevertheless, potent MTM-S-DABOs can be obtained by introducing a 2,6-difluorophenylmethyl moiety as a C-6 substituent.