N~2~-{(2R,3S)-3-[Formyl(Hydroxy)Amino]-2-Isobutyl-4-Methylpentanoyl}-N-2-Pyridinyl-L-Isoleucinamide

Molecule SVG Image

Properties Simple | Detailed

Formula C22H36N4O4
IUPAC Name (2r,3s)-3-[formyl(hydroxy)amino]-2-isobutyl-4-methyl-n-[(1s,2s)-2-methyl-1-(2-pyridylcarbamoyl)butyl]pentanamide
Molecular Mass 420.546 g·mol−1
Heat of Formation -710.2 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 547.0 Å 3
Surface Area 434.71 Å 2
HOMO Energy -9.18 ± 0.55 eV
LUMO Energy -0.21 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s)-3-(formyl-hydroxy-amino)-2-isobutyl-4-methyl-n-[(1s,2s)-2-methyl-1-(2-pyridylcarbamoyl)butyl]pentanamide
  • (2r,3s)-3-(formyl-hydroxy-amino)-2-isobutyl-4-methyl-n-[(1s,2s)-2-methyl-1-(2-pyridylcarbamoyl)butyl]valeramide
  • (2r,3s)-3-(formyl-hydroxyamino)-2-(2-methyl-1-propyl)-4-methylpentanoic acid, ((1s,2s)-2-methyl-1-(2-pyridylcarbamoyl)-1-butyl)amide
  • (2r,3s)-3-(formyl-hydroxyamino)-2-isobutyl-4-methyl-n-[(1s,2s)-2-methyl-1-[oxo-(2-pyridylamino)methyl]butyl]pentanamide
  • (2r,3s)-3-(formyl-hydroxyamino)-4-methyl-n-[(2s,3s)-3-methyl-1-oxo-1-(pyridin-2-ylamino)pentan-2-yl]-2-(2-methylpropyl)pentanamide
  • (2r,3s)-3-(hydroxy-methanoyl-amino)-4-methyl-n-[(2s,3s)-3-methyl-1-oxo-1-(pyridin-2-ylamino)pentan-2-yl]-2-(2-methylpropyl)pentanamide
  • gw-3333
  • gw3333
CAS Number(s)
  • 212609-68-2
InChIKey SMZPWUUYPYYHIV-HNJRGHQBSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N