1254713-66-0

Basic information

• Product Name: (3-tert-butyl-1-(4-methoxyphenyl)-1H-pyrazol-5-yl)methanamine
• CAS NO: 1254713-66-0
• Molecular Weight: 259.351
• Mol File: 1254713-66-0.mol

Chemical Properties

• CAS DataBase Reference: (3-tert-butyl-1-(4-methoxyphenyl)-1H-pyrazol-5-yl)methanamine(CAS DataBase Reference)
• NIST Chemistry Reference: (3-tert-butyl-1-(4-methoxyphenyl)-1H-pyrazol-5-yl)methanamine(1254713-66-0)
• EPA Substance Registry System: (3-tert-butyl-1-(4-methoxyphenyl)-1H-pyrazol-5-yl)methanamine(1254713-66-0)

Safety Data

• Hazardous Substances Data: 1254713-66-0(Hazardous Substances Data)

Upstream product

• 13395-36-3 ethyl trimethylacetopyruvate 
• 59997-51-2 trimethylacetylacetonitrile 
• 227623-26-9 3-tert-butyl-1-(4-methoxyphenyl)-1H-pyrazol-5-amine 
• 1254717-17-3 tert-butyl (3-tert-butyl-1H-pyrazol-5-yl)methylcarbamate 
• 83405-70-3 ethyl 3-(tert-butyl)-1H-pyrazole-5-carboxylate 

Downstream Products

• 1255040-45-9 N-((3-tert-butyl-1-(4-methoxyphenyl)-1H-pyrazol-5-yl)methyl)-2-(3-fluoro-4-(methylsulphonamido)phenyl)propanamide 

Relevant articles and documents

Discovery of 1-(1H-indazol-4-yl)-3-((1-phenyl-1H-pyrazol-5-yl)methyl) ureas as potent and thermoneutral TRPV1 antagonists

A series of 1-indazol-3-(1-phenylpyrazol-5-yl)methyl ureas were investigated as hTRPV1 antagonists. The structure–activity relationship study was conducted systematically for both the indazole A-region and the 3-trifluoromethyl/t-butyl pyrazole C-region to optimize the antagonism toward the activation by capsaicin. Among them, the antagonists 26, 50 and 51 displayed highly potent antagonism with Ki(CAP) = 0.4–0.5 nM. Further, in vivo studies in mice indicated that these derivatives both antagonized capsaicin induced hypothermia, consistent with their in vitro activity, and themselves did not induce hyperthermia. In the formalin model, 51 showed anti-nociceptive activity in a dose-dependent manner.

Pyrazole C-region analogues of 2-(3-fluoro-4-methylsulfonylaminophenyl)propanamides as potent TRPV1 antagonists

A series of 1-substituted 3-(t-butyl/trifluoromethyl)pyrazole C-region analogues of 2-(3-fluoro-4-methylsulfonamidophenyl)propanamides were investigated for hTRPV1 antagonism. The structure activity relationship indicated that the 3-chlorophenyl group at the 1-position of pyrazole was the optimized hydrophobic group for antagonistic potency and the activity was stereospecific to the S-configuration, providing exceptionally potent antagonists 13S and 16S with Ki(CAP) = 0.1 nM. Particularly significant, 13S exhibited antagonism selective for capsaicin and NADA and not for low pH or elevated temperature. Both compounds also proved to be very potent antagonists for rTRPV1, blocking in vivo the hypothermic action of capsaicin, consistent with their in vitro mechanism. The docking study of compounds 13S and 16S in our hTRPV1 homology model indicated that the binding modes differed somewhat, with that of 13S more closely resembling that of GRT12360.