RefChem:1097368 structure

RefChem:1097368

1-methylpyridin-1-ium;3-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]-2-oxo-4H-imidazol-5-olate

Also Known As: Pyridinium, 1-methyl-, salt with 1-(((5-(4-nitrophenyl)-2-furanyl)methylene)amino)-2,4-imidazolidinedione, hydrate (1:1:1)|1-methylpyridine; 1-[[5-(4-nitrophenyl)-2-furyl]methylideneamino]-4-oxo-5H-imidazol-2-olate

CAS: 69959-22-4
Molecular Formula C20H17N5O5
Molecular Weight 407.12296 g/mol
LogP 1.8942
Topological Polar Surface Area 128.25 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 407.12296
Monoisotopic Mass 407.12296
Heavy Atoms 30
Complexity 1090.2897

Chemical Identifiers

CAS Number 69959-22-4
SMILES C[N+]1=CC=CC=C1.C1C(=NC(=O)N1/N=C/C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])[O-]

Product Overview

RefChem:1097368 (CAS 69959-22-4), with molecular formula C20H17N5O5 and molecular weight 407.12296 g/mol. IUPAC: 1-methylpyridin-1-ium;3-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]-2-oxo-4H-imidazol-5-olate.

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