Spebrutinib
Properties
| Property | Value |
|---|---|
| Formula | C22H22FN5O3 |
| IUPAC Name | n-[3-[[5-fluoro-2-[4-(2-methoxyethoxy)anilino]pyrimidin-4-yl]amino]phenyl]prop-2-enamide |
| Molecular Mass | 423.440 g·mol−1 |
| Heat of Formation | -264.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.31 ± 1.08 D |
| Volume | 498.99 Å 3 |
| Surface Area | 374.99 Å 2 |
| HOMO Energy | -8.41 ± 0.55 eV |
| LUMO Energy | -0.52 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KXBDTLQSDKGAEB-UHFFFAOYSA-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 F |