(7R,8R,9R)-7-(2-Methoxyethoxy)-2,3-Dimethyl-9-Phenyl-7,8,9,10-Tetrahydroimidazo[1,2-H][1,7]Naphthyridin-8-Ol

Molecule SVG Image

Properties Simple | Detailed

Formula C21H26N3O3+
IUPAC Name (7r,8r,9r)-7-(2-methoxyethoxy)-2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydro-5h-imidazo[1,2-h][1,7]naphthyridin-4-ium-5-ylium-8-ol
Molecular Mass 368.449 g·mol−1
Heat of Formation -271.7 ± 16.7 kJ·mol−1
Dipole Moment 2.07 ± 1.08 D
Volume 442.46 Å 3
Surface Area 354.29 Å 2
HOMO Energy -8.17 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry C1
Synonyms
  • (7r,8r,9r)-7-(2-methoxyethoxy)-2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo(1,2-h)(1,7)naphtyridin-8-ol
  • soraprazan
CAS Number(s)
  • 261944-46-1
InChIKey PWILYDZRJORZDR-MISYRCLQSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N