2-(Isobutylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine

Base Information

• Chemical Name: 2-(Isobutylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine
• CAS No.: 51646-20-9
• Molecular Formula: C11H16N4S
• DSSTox Substance ID: DTXSID201157539
• ChEMBL ID: CHEMBL337734
• Mol file: 51646-20-9.mol

Synonyms:CHEMBL337734;DTXSID201157539;STK768004;AKOS001729120;SR-01000538263;SR-01000538263-1;2-(isobutylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine;5,7-Dimethyl-2-[(2-methylpropyl)thio][1,2,4]triazolo[1,5-a]pyrimidine;5,7-dimethyl-2-[(2-methylpropyl)sulfanyl][1,2,4]triazolo[1,5-a]pyrimidine;51646-20-9

Chemical Property of 2-(Isobutylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 236.10956770
• Heavy Atom Count: 16
• Complexity: 236

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=NC2=NC(=NN12)SCC(C)C)C