AC1LZUHQ structure

AC1LZUHQ

(6E)-6-[(6-hydroxy-4-oxochromen-3-yl)methylidene]-5-imino-[1,3]thiazolo[3,2-a]pyrimidin-7-one

Also Known As: (6E)-6-[(6-hydroxy-4-oxochromen-3-yl)methylidene]-5-imino-[1,3]thiazolo[3,2-a]pyrimidin-7-one|(E)-6-((6-hydroxy-4-oxo-4H-chromen-3-yl)methylene)-5-imino-5H-thiazolo[3,2-a]pyrimidin-7(6H)-one|6-[1-(6-Hydroxy-4-oxo-4H-chromen-3-yl)-meth-(E)-ylidene]-5-imino-5,6-dihydro-thiazolo[3,2-a]pyrimidin -7-one|(6E)-6-[(6-hydroxy-4-keto-chromen-3-yl)methylene]-5-imino-thiazolo[3,2-a]pyrimidin-7-one|(6E)-5-azanylidene-6-[(6-oxidanyl-4-oxidanylidene-chromen-3-yl)methylidene]-[1,3]thiazolo[3,2-a]pyrimidin-7-one|(6E)-6-[(6-hydroxy-4-oxo-1-benzopyran-3-yl)methylidene]-5-imino-7-thiazolo[3,2-a]pyrimidinone|3-[(E)-(5-iminio-7-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-4-oxo-4H-chromen-6-olate

CAS: 899385-36-5
Molecular Formula C16H9N3O4S
Molecular Weight 339.03137 g/mol
LogP 2.27547
Topological Polar Surface Area 106.96 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 1
Exact Mass 339.03137
Monoisotopic Mass 339.03137
Heavy Atoms 24
Complexity 1064.6672

Chemical Identifiers

CAS Number 899385-36-5
SMILES C1=CC2=C(C=C1O)C(=O)C(=CO2)/C=C/3\C(=N)N4C=CSC4=NC3=O

Product Overview

AC1LZUHQ (CAS 899385-36-5), with molecular formula C16H9N3O4S and molecular weight 339.03137 g/mol. IUPAC: (6E)-6-[(6-hydroxy-4-oxochromen-3-yl)methylidene]-5-imino-[1,3]thiazolo[3,2-a]pyrimidin-7-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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