N-{3-[(4S,6R)-2-Amino-4-Methyl-6-(Trifluoromethyl)-5,6-Dihydro-4H-1,3-Oxazin-4-Yl]-4-Fluorophenyl}-5-Cyano-2-Pyridinecarboxamide
Properties
| Property | Value |
|---|---|
| Formula | C19H15F4N5O2 |
| IUPAC Name | n-[3-[(4s,6r)-2-amino-4-methyl-6-(trifluoromethyl)-5,6-dihydro-1,3-oxazin-4-yl]-4-fluoro-phenyl]-5-cyano-pyridine-2-carboxamide |
| Molecular Mass | 421.348 g·mol−1 |
| Heat of Formation | -780.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.40 ± 1.08 D |
| Volume | 443.09 Å 3 |
| Surface Area | 397.33 Å 2 |
| HOMO Energy | -9.13 ± 0.55 eV |
| LUMO Energy | 1.11 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MELQHVBGGSKVJQ-QAPCUYQASA-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 |