AC1OBTPO structure

AC1OBTPO

2-[[4,5-bis(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide

Also Known As: 2-{[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-fluorophenyl)methylidene]acetohydrazide|(E)-2-((4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N'-(3-fluorobenzylidene)acetohydrazide|2-[[4,5-bis(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-fluorophenyl)methylideneamino]acetamide|N-[(1E)-2-(3-fluorophenyl)-1-azavinyl]-2-[4,5-bis(4-methoxyphenyl)(1,2,4-triaz ol-3-ylthio)]acetamide

CAS: 406464-83-3
Molecular Formula C25H22FN5O3S
Molecular Weight 491.14273 g/mol
LogP 4.333
Topological Polar Surface Area 90.63 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 9
Exact Mass 491.14273
Monoisotopic Mass 491.14273
Heavy Atoms 35
Complexity 1323.9491

Chemical Identifiers

CAS Number 406464-83-3
SMILES COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)N/N=C/C4=CC(=CC=C4)F

Product Overview

AC1OBTPO (CAS 406464-83-3), with molecular formula C25H22FN5O3S and molecular weight 491.14273 g/mol. IUPAC: 2-[[4,5-bis(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(3-fluorophenyl)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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