AC1NPV67 structure

AC1NPV67

4-bromo-N-[4-oxo-3-prop-2-enyl-5-(quinolin-2-ylmethylidene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide

Also Known As: 4-bromo-N-[4-oxo-3-prop-2-enyl-5-(quinolin-2-ylmethylidene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide|4-Bromo-N-{4-oxo-3-(prop-2-en-1-yl)-5-[(quinolin-2-yl)methylidene]-1,3-thiazolidin-2-ylidene}benzene-1-sulfonamide

CAS: 5495-86-3
Molecular Formula C22H16BrN3O3S2
Molecular Weight 512.9816 g/mol
LogP 4.8445
Topological Polar Surface Area 79.7 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 512.9816
Monoisotopic Mass 512.9816
Heavy Atoms 31
Complexity 1349.9336

Chemical Identifiers

CAS Number 5495-86-3
SMILES C=CCN1C(=O)C(=CC2=NC3=CC=CC=C3C=C2)SC1=NS(=O)(=O)C4=CC=C(C=C4)Br

Product Overview

AC1NPV67 (CAS 5495-86-3), with molecular formula C22H16BrN3O3S2 and molecular weight 512.9816 g/mol. IUPAC: 4-bromo-N-[4-oxo-3-prop-2-enyl-5-(quinolin-2-ylmethylidene)-1,3-thiazolidin-2-ylidene]benzenesulfonamide.

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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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