IUPAC name
6-(1,1-dimethylethyl)-8-fluoro-2,3-dimethyl-4-quinolinyl acetate
SMILES
Cc1c(C)nc2c(cc(cc2F)C(C)(C)C)c1OC(=O)C
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
tebufloquin
IUPAC name
6-(1,1-dimethylethyl)-8-fluoro-2,3-dimethyl-4-quinolinyl acetate
SMILES
Cc1c(C)nc2c(cc(cc2F)C(C)(C)C)c1OC(=O)C
INCHI
InChI=1S/C17H20FNO2/c1-9-10(2)19-15-13(16(9)21-11(3)20)7-12(8-14(15)18)17(4,5)6/h7-8H,1-6H3
FORMULA
C17H20FNO2
Common name
tebufloquin
IUPAC name
6-(1,1-dimethylethyl)-8-fluoro-2,3-dimethyl-4-quinolinyl acetate
Molecular weight
289.345
clogP
5.032
clogS
-5.732
HBond Acceptor
3
HBond Donor
0
Total Polar Surface Area
39.19
Number of Rings
2
Rotatable Bond
3
