Telcagepant
Properties
Property | Value |
---|---|
Formula | C26H27F5N6O3 |
IUPAC Name | n-[(3r,6s)-6-(2,3-difluorophenyl)-2-oxo-1-(2,2,2-trifluoroethyl)azepan-3-yl]-4-(2-oxo-3h-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide |
Molecular Mass | 566.523 g·mol−1 |
Heat of Formation | -1357.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.87 ± 1.08 D |
Volume | 613.42 Å 3 |
Surface Area | 478.26 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | -0.62 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | CGDZXLJGHVKVIE-DNVCBOLYSA-N |
QR Code | Generate QR Code |
Links | PubChem Wikipedia ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C F O N |