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89112-85-6

89112-85-6 | 2'-Methoxy-6-methylflavone

CAS No: 89112-85-6 Catalog No: AG0035VB MDL No:

Product Description

Catalog Number:
AG0035VB
Chemical Name:
2'-Methoxy-6-methylflavone
CAS Number:
89112-85-6
Molecular Formula:
C17H14O3
Molecular Weight:
266.2913
IUPAC Name:
2-(2-methoxyphenyl)-6-methylchromen-4-one
InChI:
InChI=1S/C17H14O3/c1-11-7-8-16-13(9-11)14(18)10-17(20-16)12-5-3-4-6-15(12)19-2/h3-10H,1-2H3
InChI Key:
QEIHFNZSIRWEBX-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1cc(=O)c2c(o1)ccc(c2)C

Properties

Complexity:
401  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.094g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.296g/mol
Monoisotopic Mass:
266.094g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Literature

Title Journal
2'-Methoxy-6-methylflavone: a novel anxiolytic and sedative with subtype selective activating and modulating actions at GABA(A) receptors. British journal of pharmacology 20120201
Refinement and evaluation of a pharmacophore model for flavone derivatives binding to the benzodiazepine site of the GABA(A) receptor. Journal of medicinal chemistry 20020912

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