2-(4-{3-[2-(Trifluoromethyl)-10H-Phenothiazin-10-Yl]Propyl}-1-Piperazinyl)Ethyl β-L-Glycero-Hexopyranosiduronic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C28H34F3N3O7S
IUPAC Name (2s,3s,4r,5s,6r)-3,4,5-trihydroxy-6-[2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethoxy]tetrahydropyran-2-carboxylic acid
Molecular Mass 613.646 g·mol−1
Heat of Formation -1675.2 ± 16.7 kJ·mol−1
Dipole Moment 5.79 ± 1.08 D
Volume 681.99 Å 3
Surface Area 552.92 Å 2
HOMO Energy -7.87 ± 0.55 eV
LUMO Energy -1.11 ± eV
Point Group Symmetry C1
InChIKey FPAXYGQWHAIDFV-UZMBMHPJSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N S