N-[(2R)-1-(1,4'-Bipiperidin-1'-Yl)-3-(7-Methyl-1H-Indazol-5-Yl)-1-Oxo-2-Propanyl]-4-(8-Fluoro-2-Oxo-1,4-Dihydro-3(2H)-Quinazolinyl)-1-Piperidinecarboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C35H45FN8O3
IUPAC Name 4-(8-fluoro-2-oxo-1,4-dihydroquinazolin-3-yl)-n-[(1r)-1-[(7-methylindazol-1-ium-2-id-5-yl)methyl]-2-oxo-2-[4-(1-piperidyl)-1-piperidyl]ethyl]piperidine-1-carboxamide
Molecular Mass 644.782 g·mol−1
Heat of Formation -461.9 ± 16.7 kJ·mol−1
Dipole Moment 4.09 ± 1.08 D
Volume 786.68 Å 3
Surface Area 606.88 Å 2
HOMO Energy -8.27 ± 0.55 eV
LUMO Energy -0.37 ± eV
Point Group Symmetry C1
InChIKey HBOINTMVWRSZQS-SSEXGKCCSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F