Filgotinib

Molecule SVG Image

Properties Simple | Detailed

Formula C21H23N5O3S
IUPAC Name n-[5-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-6h-[1,2,4]triazolo[1,5-a]pyridin-4-ium-6-id-2-yl]cyclopropanecarboxamide
Molecular Mass 425.504 g·mol−1
Heat of Formation 41.0 ± 16.7 kJ·mol−1
Dipole Moment 5.95 ± 1.08 D
Volume 488.01 Å 3
Surface Area 427.15 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy 2.16 ± eV
Point Group Symmetry C1
InChIKey RIJLVEAXPNLDTC-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N