Vismodegib

Molecule SVG Image

Properties Simple | Detailed

Formula C19H14Cl2N2O3S
IUPAC Name 2-chloro-n-[4-chloro-3-(2-pyridyl)phenyl]-4-methylsulfonyl-benzamide
Molecular Mass 421.297 g·mol−1
Heat of Formation -250.9 ± 16.7 kJ·mol−1
Dipole Moment 1.95 ± 1.08 D
Volume 442.53 Å 3
Surface Area 391.51 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy -1.71 ± eV
Point Group Symmetry C1
Synonyms
  • 2-chloro-n-(4-chloro-3-pyridin-2-yl-phenyl)-4-methylsulfonyl-benzamide
  • 2-chloro-n-(4-chloro-3-pyridin-2-ylphenyl)-4-methylsulfonylbenzamide
  • 2-chloro-n-[4-chloro-3-(2-pyridyl)phenyl]-4-mesyl-benzamide
  • 2-chloro-n-[4-chloro-3-(2-pyridyl)phenyl]-4-methylsulfonyl-benzamide
  • 2-chloro-n-[4-chloro-3-(2-pyridyl)phenyl]-4-methylsulfonylbenzamide
InChIKey BPQMGSKTAYIVFO-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C Cl H O N S