N'-{(2S,3R)-3-Hydroxy-4-[(3-Methoxybenzyl)Amino]-1-Phenyl-2-Butanyl}-N,N-Dipropylisophthalamide

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Properties Simple | Detailed

Formula C32H41N3O4
IUPAC Name n1-[(1s,2r)-1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-n3,n3-dipropyl-benzene-1,3-dicarboxamide
Molecular Mass 531.686 g·mol−1
Heat of Formation -570.4 ± 16.7 kJ·mol−1
Dipole Moment 6.59 ± 1.08 D
Volume 679.63 Å 3
Surface Area 540.01 Å 2
HOMO Energy -8.84 ± 0.55 eV
LUMO Energy 2.40 ± eV
Point Group Symmetry C1
Synonyms
  • l01
  • n-[(1s,2r)-1-(benzyl)-2-hydroxy-3-[(3-methoxybenzyl)amino]propyl]-n',n'-dipropyl-isophthalamide
  • n-[(1s,2r)-2-hydroxy-3-[(3-methoxyphenyl)methylamino]-1-(phenylmethyl)propyl]-n',n'-dipropyl-benzene-1,3-dicarboxamide
  • n-[(1s,2r)-2-hydroxy-3-[(3-methoxyphenyl)methylamino]-1-(phenylmethyl)propyl]-n',n'-dipropylbenzene-1,3-dicarboxamide
  • n-[(2s,3r)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenyl-butan-2-yl]-n',n'-dipropyl-benzene-1,3-dicarboxamide
  • n-[(2s,3r)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-n',n'-dipropylbenzene-1,3-dicarboxamide
InChIKey WPRACYICKOKGTO-XZWHSSHBSA-N
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