Formula |
C23H26F3N3O2S |
IUPAC Name |
n-[(2r)-2-(2-aminoethylsulfanyl)propyl]-6-methoxy-4-methyl-5-[3-(trifluoromethyl)phenoxy]quinolin-8-amine |
Molecular Mass |
465.532 g·mol−1 |
Heat of Formation |
-718.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.48 ± 1.08 D |
Volume |
536.57 Å 3 |
Surface Area |
454.33 Å 2 |
HOMO Energy |
-7.82 ± 0.55 eV |
LUMO Energy |
-0.50 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
WNXGHHIWNSYKLL-OAHLLOKOSA-N |
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Links |
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Elements |
C
F
H
O
N
S
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