Formula |
C24H28Cl2FN5O5S2 |
IUPAC Name |
5-chloro-n-[(2s)-2-[[2-chloro-5-fluoro-3-(2-oxo-1-piperidyl)phenyl]sulfonylamino]-3-(4-methylpiperazin-1-yl)-3-oxo-propyl]thiophene-2-carboxamide |
Molecular Mass |
620.544 g·mol−1 |
Heat of Formation |
-894.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.34 ± 1.08 D |
Volume |
670.84 Å 3 |
Surface Area |
508.25 Å 2 |
HOMO Energy |
-9.34 ± 0.55 eV |
LUMO Energy |
-1.08 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
PVTLJXXAPWJMAT-INIZCTEOSA-N |
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Links |
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Elements |
C
F
H
Cl
O
N
S
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