6-(2,4-Difluorophenoxy)-8-Methyl-2-{[(2S)-1-(2H-Tetrazol-2-Yl)-2-Propanyl]Amino}Pyrido[2,3-D]Pyrimidin-7(8H)-One
Properties
| Property | Value |
|---|---|
| Formula | C18H16F2N8O2 |
| IUPAC Name | 2-[[(1s)-2-(3,4-diaza-2-azonia-1-azanidacyclopenta-2,4-dien-2-yl)-1-methyl-ethyl]amino]-6-(2,4-difluorophenoxy)-8-methyl-pyrido[2,3-d]pyrimidin-8-ium-6-ylium-7-one |
| Molecular Mass | 414.369 g·mol−1 |
| Heat of Formation | -74.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.35 ± 1.08 D |
| Volume | 453.07 Å 3 |
| Surface Area | 386.91 Å 2 |
| HOMO Energy | -8.86 ± 0.55 eV |
| LUMO Energy | 1.92 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WIGNNIARPGHXFO-JTQLQIEISA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C F O N |