5-Oxo-5-{[(2S)-1-Oxo-1-{[2-Oxo-4-(Trifluoromethyl)-1,2-Dihydro-7-Quinolinyl]Amino}-3-Phenyl-2-Propanyl]Amino}Pentanoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C24H22F3N3O5
IUPAC Name 5-[[(1s)-1-benzyl-2-oxo-2-[[2-oxo-4-(trifluoromethyl)-1h-quinolin-7-yl]amino]ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 489.444 g·mol−1
Heat of Formation -1394.4 ± 16.7 kJ·mol−1
Dipole Moment 7.31 ± 1.08 D
Volume 549.99 Å 3
Surface Area 455.42 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy -1.47 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[[(1s)-1-(benzyl)-2-keto-2-[[2-keto-4-(trifluoromethyl)-1h-quinolin-7-yl]amino]ethyl]amino]-5-keto-valeric acid
  • 5-oxo-5-[[(1s)-2-oxo-2-[[2-oxo-4-(trifluoromethyl)-1h-quinolin-7-yl]amino]-1-(phenylmethyl)ethyl]amino]pentanoic acid
  • 5-oxo-5-[[(2s)-1-oxo-1-[[2-oxo-4-(trifluoromethyl)-1h-quinolin-7-yl]amino]-3-phenyl-propan-2-yl]amino]pentanoic acid
  • 5-oxo-5-[[(2s)-1-oxo-1-[[2-oxo-4-(trifluoromethyl)-1h-quinolin-7-yl]amino]-3-phenylpropan-2-yl]amino]pentanoic acid
  • 7-glutaryl-phenylalaninamide-4-trifluoromethyl-2-quinolinone
  • glt-phe-nh-fmeq
CAS Number(s)
  • 111574-81-3
InChIKey LCIFDCMSPBIPOT-IBGZPJMESA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F