Formula |
C22H28N6O4 |
IUPAC Name |
2-(3,5-dimethoxyanilino)-5-ethyl-7-[(2r)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide |
Molecular Mass |
440.496 g·mol−1 |
Heat of Formation |
3096.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.83 ± 1.08 D |
Volume |
450.83 Å 3 |
Surface Area |
392.01 Å 2 |
HOMO Energy |
-9.64 ± 0.55 eV |
LUMO Energy |
-3.37 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ITADTXCJWWSRJO-OAHLLOKOSA-N |
QR Code |
Generate QR Code |
Links |
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
C
O
N
|
|
|