Formula |
C26H33N5O4S2 |
IUPAC Name |
(2r)-3-cyclopentyl-n-(5-methoxythiazolo[5,4-b]pyridin-2-yl)-2-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]propanamide |
Molecular Mass |
543.701 g·mol−1 |
Heat of Formation |
-402.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.35 ± 1.08 D |
Volume |
626.95 Å 3 |
Surface Area |
533.73 Å 2 |
HOMO Energy |
-8.82 ± 0.55 eV |
LUMO Energy |
-0.89 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
GMGMDWSPSKXMJH-OAQYLSRUSA-N |
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Elements |
H
S
C
O
N
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