| Formula |
C20H22ClN7OS |
| IUPAC Name |
(3r)-1-[5-chloro-6-ethyl-2-[(5-hydroxy-8h-1,5-naphthyridin-3-yl)sulfanyl]-7h-pyrrolo[2,3-d]pyrimidin-4-yl]pyrrolidin-3-amine |
| Molecular Mass |
443.953 g·mol−1 |
| Heat of Formation |
2891.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.90 ± 1.08 D |
| Volume |
411.75 Å 3 |
| Surface Area |
365.7 Å 2 |
| HOMO Energy |
-8.73 ± 0.55 eV |
| LUMO Energy |
-3.40 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
GAOGTYTXXMCXHI-LLVKDONJSA-N |
| QR Code |
Generate QR Code |
| Links |
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
C
N
S
O
Cl
|
| |
|
