AC1LLTJH structure

AC1LLTJH

2-[4-(3-methylphenyl)piperazin-1-yl]-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-4-one

Also Known As: BAS 01126921|2-[4-(3-methylphenyl)piperazin-1-yl]-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-4-one|2-[4-(3-Methylphenyl)piperazin-1-yl]-5-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazol-4(5H)-one

CAS: 5714-69-2
Molecular Formula C25H22N4O4S
Molecular Weight 474.13617 g/mol
LogP 4.95572
Topological Polar Surface Area 92.19 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 474.13617
Monoisotopic Mass 474.13617
Heavy Atoms 34
Complexity 1304.4597

Chemical Identifiers

CAS Number 5714-69-2
SMILES CC1=CC(=CC=C1)N2CCN(CC2)C3=NC(=O)C(=CC4=CC=C(O4)C5=CC=C(C=C5)[N+](=O)[O-])S3

Product Overview

AC1LLTJH (CAS 5714-69-2), with molecular formula C25H22N4O4S and molecular weight 474.13617 g/mol. IUPAC: 2-[4-(3-methylphenyl)piperazin-1-yl]-5-[[5-(4-nitrophenyl)furan-2-yl]methylidene]-1,3-thiazol-4-one.

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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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