AC1MQTCU structure

AC1MQTCU

2-(4-bromophenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one

Also Known As: 5-(4-Bromophenyl)-1-(6-fluorobenzothiazol-2-yl)-3-hydroxy-4-(2-thienylcarbonyl)-3-pyrrolin-2-one|(4E)-5-(4-bromophenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-[hydroxy(thiophen-2-yl)methylidene]pyrrolidine-2,3-dione|2-(4-bromophenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one|5-(4-bromophenyl)-1-(6-fluorobenzo[d]thiazol-2-yl)-3-hydroxy-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one|5-(4-bromophenyl)-1-(6-fluorobenzothiazol-2-yl)-3-hydroxy-4-(2-thienylcarbonyl )-3-pyrrolin-2-one|5-(4-bromophenyl)-1-(6-fluorobenzothiazol-2-yl)-3-hydroxy-4-(thiophene-2-carbonyl)-5H-pyrrol-2-one

CAS: 514191-73-2
Molecular Formula C22H12BrFN2O3S2
Molecular Weight 513.9457 g/mol
LogP 6.0423
Topological Polar Surface Area 70.5 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 513.9457
Monoisotopic Mass 513.9457
Heavy Atoms 31
Complexity 1363.4374

Chemical Identifiers

CAS Number 514191-73-2
SMILES C1=CSC(=C1)C(=O)C2=C(C(=O)N(C2C3=CC=C(C=C3)Br)C4=NC5=C(S4)C=C(C=C5)F)O

Product Overview

AC1MQTCU (CAS 514191-73-2), with molecular formula C22H12BrFN2O3S2 and molecular weight 513.9457 g/mol. IUPAC: 2-(4-bromophenyl)-1-(6-fluoro-1,3-benzothiazol-2-yl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-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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