N-Ethyl-2-Fluoro-N-Methyl-4-{(5R)-5-[2-Methyl-1-Oxo-1-(1,3,4-Thiadiazol-2-Ylamino)-2-Propanyl]-5H-Chromeno[2,3-B]Pyridin-2-Yl}Benzamide
Properties
Property | Value |
---|---|
Formula | C28H26FN5O3S |
IUPAC Name | 4-[(5r)-5-[1,1-dimethyl-2-oxo-2-(1,3,4-thiadiazol-2-ylamino)ethyl]-5h-chromeno[2,3-b]pyridin-2-yl]-n-ethyl-2-fluoro-n-methyl-benzamide |
Molecular Mass | 531.601 g·mol−1 |
Heat of Formation | -194.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.54 ± 1.08 D |
Volume | 606.01 Å 3 |
Surface Area | 488.77 Å 2 |
HOMO Energy | -9.34 ± 0.55 eV |
LUMO Energy | 1.85 ± eV |
Point Group Symmetry | C1 |
InChIKey | DZBKAUMYTFPJIS-HSZRJFAPSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C F H O N S |