AC1NSZB2 structure

AC1NSZB2

ethyl (2Z)-2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-7-methyl-5-(4-methylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Also Known As: AM-879/11808034|ethyl (2Z)-2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-7-methyl-5-(4-methylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate|ethyl 2-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-7-methyl-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate|(Z)-ethyl 2-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-7-methyl-3-oxo-5-(p-tolyl)-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate

CAS: 354557-22-5
Molecular Formula C26H25BrN2O5S
Molecular Weight 556.0668 g/mol
LogP 3.97352
Topological Polar Surface Area 90.12 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 556.0668
Monoisotopic Mass 556.0668
Heavy Atoms 35
Complexity 1502.1599

Chemical Identifiers

CAS Number 354557-22-5
SMILES CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=C(C=C4)C)Br)O

Product Overview

AC1NSZB2 (CAS 354557-22-5), with molecular formula C26H25BrN2O5S and molecular weight 556.0668 g/mol. IUPAC: ethyl (2Z)-2-[(3-bromo-5-ethoxy-4-hydroxyphenyl)methylidene]-7-methyl-5-(4-methylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.

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