Formula |
C33H29N7O2S |
IUPAC Name |
n-[3-[5-[2-(4-morpholinoanilino)pyrimidin-4-yl]imidazo[2,1-b]thiazol-6-yl]phenyl]-2-phenyl-acetamide |
Molecular Mass |
587.694 g·mol−1 |
Heat of Formation |
450.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.22 ± 1.08 D |
Volume |
680.0 Å 3 |
Surface Area |
578.97 Å 2 |
HOMO Energy |
-8.19 ± 0.55 eV |
LUMO Energy |
-1.03 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
BFTPDUXUTFGDLP-UHFFFAOYSA-N |
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Elements |
H
C
S
O
N
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