Formula |
C32H37FN6O6S |
IUPAC Name |
n3-[(1s,2s)-1-benzyl-2-hydroxy-3-[4-[(1s)-1-hydroxyethyl]triazol-1-yl]propyl]-n1-[(1r)-1-(4-fluorophenyl)ethyl]-5-[methyl(methylsulfonyl)amino]benzene-1,3-dicarboxamide |
Molecular Mass |
652.736 g·mol−1 |
Heat of Formation |
-846.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.77 ± 1.08 D |
Volume |
774.12 Å 3 |
Surface Area |
599.25 Å 2 |
HOMO Energy |
-9.32 ± 0.55 eV |
LUMO Energy |
-0.87 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
CUYAHRWSXUTTQB-PELBXYKSSA-N |
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Elements |
C
F
H
O
N
S
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