AC1NRBNY structure

AC1NRBNY

2-chloro-5-[5-[(6-ethoxycarbonyl-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoate

Also Known As: 2-Chloro-5-(5-{[6-(ethoxycarbonyl)-7-methyl-3-oxo-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoate|2-chloro-5-[5-[(6-ethoxycarbonyl-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoate

CAS: 6829-99-8
Molecular Formula C26H18ClN2O6S2-
Molecular Weight 553.0295 g/mol
LogP 3.1367
Topological Polar Surface Area 113.93 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 9
Rotatable Bonds 6
Exact Mass 553.0295
Monoisotopic Mass 553.0295
Heavy Atoms 37
Complexity 1743.5897

Chemical Identifiers

CAS Number 6829-99-8
SMILES CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC=C(O4)C5=CC(=C(C=C5)Cl)C(=O)[O-])S2)C

Product Overview

AC1NRBNY (CAS 6829-99-8), with molecular formula C26H18ClN2O6S2- and molecular weight 553.0295 g/mol. IUPAC: 2-chloro-5-[5-[(6-ethoxycarbonyl-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene)methyl]furan-2-yl]benzoate.

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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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