5-[(4'-Amino-1'-Ethyl-5',8'-Difluoro-1H,1'H-Spiro[Piperidine-4,2'-Quinazolin]-1-Yl)Carbonyl]-3,4-Dihydro-2-Pyridinecarbonitrile
Properties
Property | Value |
---|---|
Formula | C21H22F2N6O |
IUPAC Name | 5-[(1's)-4'-amino-1'-ethyl-5',8'-difluoro-spiro[piperidine-4,2'-quinazoline]-1-carbonyl]-3,4-dihydropyridine-2-carbonitrile |
Molecular Mass | 412.436 g·mol−1 |
Heat of Formation | -125.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.36 ± 1.08 D |
Volume | 474.25 Å 3 |
Surface Area | 387.5 Å 2 |
HOMO Energy | -9.24 ± 0.55 eV |
LUMO Energy | 1.75 ± eV |
Point Group Symmetry | C1 |
InChIKey | QCFIRACCCDFXIP-UHFFFAOYSA-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 |