N'-[(1S,2S)-1-[(4S)-1-Benzyl-5-Oxo-4-Imidazolidinyl]-3-(3,5-Difluorophenyl)-1-Hydroxy-2-Propanyl]-5-Methyl-N,N-Dipropylisophthalamide

Molecule SVG Image

Properties Simple | Detailed

Formula C34H40F2N4O4
IUPAC Name n1-[(1s,2s)-2-[(4s)-1-benzyl-5-oxo-imidazolidin-4-yl]-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-ethyl]-5-methyl-n3,n3-dipropyl-benzene-1,3-dicarboxamide
Molecular Mass 606.703 g·mol−1
Heat of Formation -975.4 ± 16.7 kJ·mol−1
Dipole Moment 5.73 ± 1.08 D
Volume 751.32 Å 3
Surface Area 601.27 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy 2.53 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1s,2s)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(4s)-5-oxo-1-(phenylmethyl)-4-imidazolidinyl]ethyl]-5-methyl-n',n'-dipropylbenzene-1,3-dicarboxamide
  • n-[(1s,2s)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(4s)-5-oxo-1-(phenylmethyl)imidazolidin-4-yl]ethyl]-5-methyl-n',n'-dipropyl-benzene-1,3-dicarboxamide
  • n-[(1s,2s)-2-[(4s)-1-(benzyl)-5-keto-imidazolidin-4-yl]-1-(3,5-difluorobenzyl)-2-hydroxy-ethyl]-5-methyl-n',n'-dipropyl-isophthalamide
  • n-[(1s,2s)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(4s)-5-oxo-1-(phenylmethyl)imidazolidin-4-yl]propan-2-yl]-5-methyl-n',n'-dipropyl-benzene-1,3-dicarboxamide
  • n-[(1s,2s)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(4s)-5-oxo-1-(phenylmethyl)imidazolidin-4-yl]propan-2-yl]-5-methyl-n',n'-dipropylbenzene-1,3-dicarboxamide
InChIKey HZWNNIVRFLRAQW-CHQNGUEUSA-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