3-{[(4H-1,2,4-Triazol-4-yl)amino]methyl}-1,3-benzothiazole-2(3H)-thione

Base Information

• Chemical Name: 3-{[(4H-1,2,4-Triazol-4-yl)amino]methyl}-1,3-benzothiazole-2(3H)-thione
• CAS No.: 141186-37-0
• Molecular Formula: C10H9N5S2
• DSSTox Substance ID: DTXSID90568442
• Wikidata: Q82454695
• Mol file: 141186-37-0.mol

Synonyms:141186-37-0;DTXSID90568442;3-{[(4H-1,2,4-Triazol-4-yl)amino]methyl}-1,3-benzothiazole-2(3H)-thione

Chemical Property of 3-{[(4H-1,2,4-Triazol-4-yl)amino]methyl}-1,3-benzothiazole-2(3H)-thione

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 263.02993766
• Heavy Atom Count: 17
• Complexity: 294

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N(C(=S)S2)CNN3C=NN=C3