Formula |
C27H31FN8O2 |
IUPAC Name |
2-fluoro-6-[[2-[4-(4-isopropylpiperazin-1-yl)-2-methoxy-anilino]-7h-pyrrolo[2,3-d]pyrimidin-4-yl]amino]benzamide |
Molecular Mass |
518.586 g·mol−1 |
Heat of Formation |
-73.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.52 ± 1.08 D |
Volume |
603.91 Å 3 |
Surface Area |
525.59 Å 2 |
HOMO Energy |
-7.89 ± 0.55 eV |
LUMO Energy |
-0.64 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
HXZDICYKFAOZLE-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
F
O
N
|
|
|