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2503-84-6

2503-84-6 | 4-Quinolinol, 2-octyl-, 1-oxide

CAS No: 2503-84-6 Catalog No: AG002Q81 MDL No:

Product Description

Catalog Number:
AG002Q81
Chemical Name:
4-Quinolinol, 2-octyl-, 1-oxide
CAS Number:
2503-84-6
Molecular Formula:
C17H23NO2
Molecular Weight:
273.3700
IUPAC Name:
1-hydroxy-2-octylquinolin-4-one
InChI:
InChI=1S/C17H23NO2/c1-2-3-4-5-6-7-10-14-13-17(19)15-11-8-9-12-16(15)18(14)20/h8-9,11-13,20H,2-7,10H2,1H3
InChI Key:
IWNHLHJZIFVFOS-UHFFFAOYSA-N
SMILES:
CCCCCCCCc1cc(O)c2c([n+]1[O-])cccc2

Properties

Complexity:
351  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.173g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
273.376g/mol
Monoisotopic Mass:
273.173g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  

Literature

Title Journal
Growth inhibition of Toxoplasma gondii and Plasmodium falciparum by nanomolar concentrations of 1-hydroxy-2-dodecyl-4(1H)quinolone, a high-affinity inhibitor of alternative (type II) NADH dehydrogenases. Antimicrobial agents and chemotherapy 20070401

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