7-Methyl-3-sulfanyl[1,2,4]triazolo[4,3-a]pyrimidin-5(8h)-one

Base Information

• Chemical Name: 7-Methyl-3-sulfanyl[1,2,4]triazolo[4,3-a]pyrimidin-5(8h)-one
• CAS No.: 92086-68-5
• Molecular Formula: C19H27ClN2O6
• NSC Number: 521879
• DSSTox Substance ID: DTXSID60358791,DTXSID40919905

Synonyms:7-methyl-3-sulfanyl[1,2,4]triazolo[4,3-a]pyrimidin-5(8h)-one;92086-68-5;STK604316;117883-72-4;7-methyl-3-sulfanyl[1,2,4]triazolo[4,3-a]pyrimidin-5-ol;3-Mercapto-7-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-5(8H)-one;91184-06-4;NSC521879;SCHEMBL17153840;DTXSID40919905;DTXSID60358791;STL441127;AKOS005226917;AKOS005540093;NSC-521879

Chemical Property of 7-Methyl-3-sulfanyl[1,2,4]triazolo[4,3-a]pyrimidin-5(8h)-one

Chemical Property:

• XLogP3: -0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 182.02623200
• Heavy Atom Count: 12
• Complexity: 332

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=O)N2C(=N1)NNC2=S

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