4-Sulfanylidene-3,4-dihydro[1,2,4]triazino[4,5-b]indazol-1(2H)-one

Base Information

• Chemical Name: 4-Sulfanylidene-3,4-dihydro[1,2,4]triazino[4,5-b]indazol-1(2H)-one
• CAS No.: 91545-23-2
• Molecular Formula: C₉H₆N₄OS
• Molecular Weight: 218.239
• DSSTox Substance ID: DTXSID90533190
• Wikidata: Q82406336
• Mol file: 91545-23-2.mol

Synonyms:91545-23-2;4-Thioxo-3,4-dihydro-[1,2,4]triazino[4,5-b]indazol-1(2H)-one;DTXSID90533190;4-Sulfanylidene-3,4-dihydro[1,2,4]triazino[4,5-b]indazol-1(2H)-one

Chemical Property of 4-Sulfanylidene-3,4-dihydro[1,2,4]triazino[4,5-b]indazol-1(2H)-one

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 218.02623200
• Heavy Atom Count: 15
• Complexity: 321

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C3C(=O)NNC(=S)N3N=C2C=C1