6-(2,4-Difluorophenoxy)-8-Methyl-2-{[(2R)-1-(2H-Tetrazol-2-Yl)-2-Propanyl]Amino}Pyrido[2,3-D]Pyrimidin-7(8H)-One

Molecule SVG Image

Properties Simple | Detailed

Formula C18H16F2N8O2
IUPAC Name 2-[[(1r)-2-(3,4-diaza-2-azonia-1-azanidacyclopenta-2,4-dien-2-yl)-1-methyl-ethyl]amino]-6-(2,4-difluorophenoxy)-8-methyl-pyrido[2,3-d]pyrimidin-8-ium-6-ylium-7-one
Molecular Mass 414.369 g·mol−1
Heat of Formation -75.4 ± 16.7 kJ·mol−1
Dipole Moment 7.56 ± 1.08 D
Volume 455.19 Å 3
Surface Area 382.6 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 1.86 ± eV
Point Group Symmetry C1
InChIKey WIGNNIARPGHXFO-SNVBAGLBSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F