Duvelisib
Properties
| Property | Value |
|---|---|
| Formula | C22H17ClN6O |
| IUPAC Name | 8-chloro-2-phenyl-3-[(1s)-1-(purin-7-ium-6-ylamino)ethyl]isoquinolin-1-one |
| Molecular Mass | 416.863 g·mol−1 |
| Heat of Formation | 354.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.65 ± 1.08 D |
| Volume | 463.69 Å 3 |
| Surface Area | 388.55 Å 2 |
| HOMO Energy | -8.72 ± 0.55 eV |
| LUMO Energy | -1.12 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SJVQHLPISAIATJ-ZDUSSCGKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O Cl |