2-{[4-(2-{[(2,4-Difluorophenyl)Carbamoyl](Heptyl)Amino}Ethyl)Phenyl]Sulfanyl}-2-Methylpropanoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C26H34F2N2O3S
IUPAC Name 2-[4-[2-[(2,4-difluorobenzene-3,5-diid-1-yl)carbamoyl-heptyl-amino]ethyl]phenyl]sulfanyl-2-methyl-propanoate
Molecular Mass 492.622 g·mol−1
Heat of Formation -396.3 ± 16.7 kJ·mol−1
Dipole Moment 5.21 ± 1.08 D
Volume 615.24 Å 3
Surface Area 523.91 Å 2
Point Group Symmetry C1
Synonyms
  • 2-[4-[2-[(2,4-difluorophenyl)carbamoyl-heptylamino]ethyl]phenyl]sulfanyl-2-methylpropanoic acid
  • 2-[[4-[2-[(2,4-difluorophenyl)carbamoyl-heptyl-amino]ethyl]phenyl]thio]-2-methyl-propionic acid
  • 2-[[4-[2-[[[(2,4-difluorophenyl)amino]-oxomethyl]-heptylamino]ethyl]phenyl]thio]-2-methylpropanoic acid
  • gw-9578
InChIKey KYQNYMXQHLMADB-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N S