AC1OBMBY structure

AC1OBMBY

1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-5-(4-propoxyphenyl)triazole-4-carboxamide

Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(4-(methylthio)benzylidene)-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-5-(4-propoxyphenyl)triazole-4-carboxamide

CAS: 896808-47-2
Molecular Formula C22H22N8O3S
Molecular Weight 478.15356 g/mol
LogP 3.1741
Topological Polar Surface Area 146.34 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 10
Rotatable Bonds 9
Exact Mass 478.15356
Monoisotopic Mass 478.15356
Heavy Atoms 34
Complexity 1282.4893

Chemical Identifiers

CAS Number 896808-47-2
SMILES CCCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)N/N=C/C4=CC=C(C=C4)SC

Product Overview

AC1OBMBY (CAS 896808-47-2), with molecular formula C22H22N8O3S and molecular weight 478.15356 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-5-(4-propoxyphenyl)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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