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

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Properties Simple | Detailed

Formula C23H31N3O6S
IUPAC Name n'-[(1s,2r)-1-benzyl-3-[cyclopropylmethyl(2-furylsulfonyl)amino]-2-hydroxy-propyl]-n-methyl-butanediamide
Molecular Mass 477.574 g·mol−1
Heat of Formation -796.3 ± 16.7 kJ·mol−1
Dipole Moment 5.87 ± 1.08 D
Volume 568.98 Å 3
Surface Area 471.96 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
Synonyms
  • muv
  • n-[(1s,2r)-1-(benzyl)-3-(cyclopropylmethyl-(2-furylsulfonyl)amino)-2-hydroxy-propyl]-n'-methyl-succinamide
  • n-[(1s,2r)-3-(cyclopropylmethyl-(2-furylsulfonyl)amino)-2-hydroxy-1-(phenylmethyl)propyl]-n'-methyl-butanediamide
  • n-[(1s,2r)-3-(cyclopropylmethyl-(2-furylsulfonyl)amino)-2-hydroxy-1-(phenylmethyl)propyl]-n'-methylbutanediamide
  • n-[(2s,3r)-4-(cyclopropylmethyl-furan-2-ylsulfonyl-amino)-3-hydroxy-1-phenyl-butan-2-yl]-n'-methyl-butanediamide
  • n-[(2s,3r)-4-(cyclopropylmethyl-furan-2-ylsulfonylamino)-3-hydroxy-1-phenylbutan-2-yl]-n'-methylbutanediamide
InChIKey IKOPFHKAECNGQI-VQTJNVASSA-N
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