1,3-Bis(benzotriazol-1-ylmethyl)thiourea

Base Information

• Chemical Name: 1,3-Bis(benzotriazol-1-ylmethyl)thiourea
• CAS No.: 28539-03-9
• Molecular Formula: C₁₅H₁₄N₈S
• Molecular Weight: 338.396
• DSSTox Substance ID: DTXSID00382676
• Wikidata: Q82174040

Synonyms:28539-03-9;1,3-Bis(1H-1,2,3-benzotriazol-1-ylmethyl)thiourea;1,3-Bis((1H-benzo[d][1,2,3]triazol-1-yl)methyl)thiourea;1,3-bis(benzotriazol-1-ylmethyl)thiourea;starbld0037717;SCHEMBL9143600;DTXSID00382676

Chemical Property of 1,3-Bis(benzotriazol-1-ylmethyl)thiourea

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 338.10621365
• Heavy Atom Count: 24
• Complexity: 411

Purity/Quality:

99% ^*data from raw suppliers

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• Canonical SMILES: C1=CC=C2C(=C1)N=NN2CNC(=S)NCN3C4=CC=CC=C4N=N3

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