(4S,4A'R,10A'S)-2-Amino-8'-(2-Fluoro-3-Pyridinyl)-1,4A'-Dimethyl-3',4',4A',10A'-Tetrahydro-2'H-Spiro[Imidazole-4,10'-Pyrano[3,2-B]Chromen]-5(1H)-One
Properties
Property | Value |
---|---|
Formula | C21H21FN4O3 |
IUPAC Name | (4ar,10s,10as)-2'-amino-8-(2-fluoro-3-pyridyl)-3',4a-dimethyl-spiro[2,3,4,10a-tetrahydropyrano[3,2-b]chromene-10,5'-imidazole]-4'-one |
Molecular Mass | 396.415 g·mol−1 |
Heat of Formation | -368.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.06 ± 1.08 D |
Volume | 446.52 Å 3 |
Surface Area | 369.8 Å 2 |
HOMO Energy | -8.81 ± 0.55 eV |
LUMO Energy | 2.45 ± eV |
Point Group Symmetry | C1 |
InChIKey | RYCBSDWTFORSET-UIFIKXQLSA-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 |