Formula |
C22H26FN3O5S |
IUPAC Name |
n-[4-(4-fluorophenyl)-5-[(e)-2-[(2s,4s)-4-hydroxy-6-oxo-tetrahydropyran-2-yl]vinyl]-6-isopropyl-pyrimidin-2-yl]-n-methyl-methanesulfonamide |
Molecular Mass |
463.522 g·mol−1 |
Heat of Formation |
-886.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.45 ± 1.08 D |
Volume |
537.12 Å 3 |
Surface Area |
433.39 Å 2 |
HOMO Energy |
-9.13 ± 0.55 eV |
LUMO Energy |
-0.85 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
SOEGVMSNJOCVHT-YXWZHEERSA-N |
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Elements |
C
F
H
O
N
S
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