2-Amino-4-{2,4-Dichloro-6-[2-(1H-Pyrazol-1-Yl)Ethoxy]Phenyl}-N-(2,2-Difluoropropyl)-5,7-Dihydro-6H-Pyrrolo[3,4-D]Pyrimidine-6-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C21H21Cl2F2N7O2 |
| IUPAC Name | 2-amino-4-[2,4-dichloro-6-(2-pyrazol-1-ium-2-id-1-ylethoxy)phenyl]-n-(2,2-difluoropropyl)-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxamide |
| Molecular Mass | 512.340 g·mol−1 |
| Heat of Formation | -439.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.96 ± 1.08 D |
| Volume | 547.93 Å 3 |
| Surface Area | 424.2 Å 2 |
| HOMO Energy | -9.17 ± 0.55 eV |
| LUMO Energy | 2.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RIVRSBWWXQQZLY-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H F O N |