AC1MS21M structure

AC1MS21M

2-amino-4-(3,4-dimethoxyphenyl)-6-[(4-methoxyphenyl)methyl]-7-methyl-5-oxo-4H-pyrano[3,2-c]pyridine-3-carbonitrile

Also Known As: 2-amino-4-(3,4-dimethoxyphenyl)-6-(4-methoxybenzyl)-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile|AO-022/43455434|2-amino-4-(3,4-dimethoxyphenyl)-6-[(4-methoxyphenyl)methyl]-7-methyl-5-oxo-4H-pyrano[3,2-c]pyridine-3-carbonitrile

CAS: 836639-94-2
Molecular Formula C26H25N3O5
Molecular Weight 459.1794 g/mol
LogP 3.449
Topological Polar Surface Area 108.73 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 459.1794
Monoisotopic Mass 459.1794
Heavy Atoms 34
Complexity 1366.909

Chemical Identifiers

CAS Number 836639-94-2
SMILES CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OC)OC)C(=O)N1CC4=CC=C(C=C4)OC

Product Overview

AC1MS21M (CAS 836639-94-2), with molecular formula C26H25N3O5 and molecular weight 459.1794 g/mol. IUPAC: 2-amino-4-(3,4-dimethoxyphenyl)-6-[(4-methoxyphenyl)methyl]-7-methyl-5-oxo-4H-pyrano[3,2-c]pyridine-3-carbonitrile.

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