N-[5-(2-Fluorophenyl)-1H-Pyrrolo[2,3-B]Pyridin-3-Yl]-5-({[(3R,4R)-3-Fluoro-4-Piperidinyl]Methyl}Amino)Pyrazolo[1,5-A]Pyrimidine-3-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C26H24F2N8O
IUPAC Name n-[5-(2-fluorophenyl)-1h-pyrrolo[2,3-b]pyridin-3-yl]-5-[[(3r,4r)-3-fluoro-4-piperidyl]methylamino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
Molecular Mass 502.519 g·mol−1
Heat of Formation 41.6 ± 16.7 kJ·mol−1
Dipole Moment 11.71 ± 1.08 D
Volume 573.51 Å 3
Surface Area 439.45 Å 2
HOMO Energy -7.98 ± 0.55 eV
LUMO Energy -1.13 ± eV
Point Group Symmetry C1
InChIKey BEXSRDRFSVXXPU-VFNWGFHPSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F