AC1NR8SZ structure

AC1NR8SZ

diethyl (2E)-5-amino-7-(2-fluorophenyl)-2-[(2-fluorophenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate

Also Known As: HMS646O06|AK-777/37037142|A1681/0071747|SR-01000423508-1|diethyl (2E)-5-amino-7-(2-fluorophenyl)-2-[(2-fluorophenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate|diethyl 5-amino-2-(2-fluorobenzylidene)-7-(2-fluorophenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate|(E)-diethyl 5-amino-2-(2-fluorobenzylidene)-7-(2-fluorophenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-6,8-dicarboxylate|6,8-DIETHYL (2E)-5-AMINO-7-(2-FLUOROPHENYL)-2-[(2-FLUOROPHENYL)METHYLIDENE]-3-OXO-2H,3H,7H-[1,3]THIAZOLO[3,2-A]PYRIDINE-6,8-DICARBOXYLATE

CAS: 330158-90-2
Molecular Formula C26H22F2N2O5S
Molecular Weight 512.12177 g/mol
LogP 2.2184
Topological Polar Surface Area 100.62 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 512.12177
Monoisotopic Mass 512.12177
Heavy Atoms 36
Complexity 1571.3252

Chemical Identifiers

CAS Number 330158-90-2
SMILES CCOC(=O)C1=C(N2C(=C(C1C3=CC=CC=C3F)C(=O)OCC)S/C(=C/C4=CC=CC=C4F)/C2=O)N

Product Overview

AC1NR8SZ (CAS 330158-90-2), with molecular formula C26H22F2N2O5S and molecular weight 512.12177 g/mol. IUPAC: diethyl (2E)-5-amino-7-(2-fluorophenyl)-2-[(2-fluorophenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate.

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