AC1OBQQP structure

AC1OBQQP

2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]acetamide

Also Known As: (E)-2-((5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N'-((5-nitrothiophen-2-yl)methylene)acetohydrazide|2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]acetamide|2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(5-nitrothiophen-2-yl)methylidene]acetohydrazide

CAS: 348103-47-9
Molecular Formula C16H13BrN6O3S2
Molecular Weight 479.96738 g/mol
LogP 3.4567
Topological Polar Surface Area 115.31 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 7
Exact Mass 479.96738
Monoisotopic Mass 479.96738
Heavy Atoms 28
Complexity 1048.6865

Chemical Identifiers

CAS Number 348103-47-9
SMILES CN1C(=NN=C1SCC(=O)N/N=C/C2=CC=C(S2)[N+](=O)[O-])C3=CC(=CC=C3)Br

Product Overview

AC1OBQQP (CAS 348103-47-9), with molecular formula C16H13BrN6O3S2 and molecular weight 479.96738 g/mol. IUPAC: 2-[[5-(3-bromophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(5-nitrothiophen-2-yl)methylideneamino]acetamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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