AC1N5HDQ structure

AC1N5HDQ

3-hydroxy-6-(hydroxymethyl)-2-[(4-methoxyanilino)-pyridin-2-ylmethyl]pyran-4-one

Also Known As: ChemDiv3_015033|AB00686347-01|SR-01000150224-1|F1654-0445|3-hydroxy-6-(hydroxymethyl)-2-{[(4-methoxyphenyl)amino](pyridin-2-yl)methyl}-4H-pyran-4-one|3-hydroxy-6-(hydroxymethyl)-2-[(4-methoxyanilino)-pyridin-2-ylmethyl]pyran-4-one|3-hydroxy-6-(hydroxymethyl)-2-(((4-methoxyphenyl)amino)(pyridin-2-yl)methyl)-4H-pyran-4-one

CAS: 690641-24-8
Molecular Formula C19H18N2O5
Molecular Weight 354.12158 g/mol
LogP 2.4428
Topological Polar Surface Area 104.82 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 354.12158
Monoisotopic Mass 354.12158
Heavy Atoms 26
Complexity 922.90955

Chemical Identifiers

CAS Number 690641-24-8
SMILES COC1=CC=C(C=C1)NC(C2=CC=CC=N2)C3=C(C(=O)C=C(O3)CO)O

Product Overview

AC1N5HDQ (CAS 690641-24-8), with molecular formula C19H18N2O5 and molecular weight 354.12158 g/mol. IUPAC: 3-hydroxy-6-(hydroxymethyl)-2-[(4-methoxyanilino)-pyridin-2-ylmethyl]pyran-4-one.

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