Formula |
C34H35F3N4O3 |
IUPAC Name |
n-[(1s,2r)-1-benzyl-2-hydroxy-3-[[3-(trifluoromethyl)phenyl]methylamino]propyl]-4-ethyl-8-(2-oxopyrrolidin-1-yl)quinoline-6-carboxamide |
Molecular Mass |
604.662 g·mol−1 |
Heat of Formation |
-886.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.56 ± 1.08 D |
Volume |
715.67 Å 3 |
Surface Area |
576.24 Å 2 |
HOMO Energy |
-9.07 ± 0.55 eV |
LUMO Energy |
-1.02 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YDNCUOPJVVQEMT-MFMCTBQISA-N |
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Links |
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Elements |
H
C
F
O
N
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