AC1OBMEX structure

AC1OBMEX

1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(anilinomethyl)-N-[(E)-[3-[(3-methylphenyl)methoxy]phenyl]methylideneamino]triazole-4-carboxamide

Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3-((3-methylbenzyl)oxy)benzylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(anilinomethyl)-N-[(E)-[3-[(3-methylphenyl)methoxy]phenyl]methylideneamino]triazole-4-carboxamide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-[(3-methylbenzyl)oxy]phenyl}methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide

CAS: 799772-50-2
Molecular Formula C27H25N9O3
Molecular Weight 523.208 g/mol
LogP 3.49592
Topological Polar Surface Area 158.37 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 10
Rotatable Bonds 10
Exact Mass 523.208
Monoisotopic Mass 523.208
Heavy Atoms 39
Complexity 1595.1254

Chemical Identifiers

CAS Number 799772-50-2
SMILES CC1=CC(=CC=C1)COC2=CC=CC(=C2)/C=N/NC(=O)C3=C(N(N=N3)C4=NON=C4N)CNC5=CC=CC=C5

Product Overview

AC1OBMEX (CAS 799772-50-2), with molecular formula C27H25N9O3 and molecular weight 523.208 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(anilinomethyl)-N-[(E)-[3-[(3-methylphenyl)methoxy]phenyl]methylideneamino]triazole-4-carboxamide.

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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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