Formula |
C27H30F3N5O5 |
IUPAC Name |
(3s)-n-[[3-(trifluoromethoxy)phenyl]methyl]-1-[2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]piperidine-3-carboxamide |
Molecular Mass |
561.553 g·mol−1 |
Heat of Formation |
-1218.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.38 ± 1.08 D |
Volume |
631.5 Å 3 |
Surface Area |
465.05 Å 2 |
HOMO Energy |
-8.32 ± 0.55 eV |
LUMO Energy |
2.56 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LDRVTAIULYJYRP-SFHVURJKSA-N |
QR Code |
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Elements |
H
C
F
O
N
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