N-(3-{(2S)-2-Hydroxy-3-[(2-{4-[(Phenylsulfonyl)Amino]Phenyl}Ethyl)Amino]Propoxy}Benzyl)Acetamide

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Formula C26H31N3O5S
IUPAC Name n-[[3-[(2s)-3-[2-[4-(benzenesulfonamido)phenyl]ethylamino]-2-hydroxy-propoxy]phenyl]methyl]acetamide
Molecular Mass 497.606 g·mol−1
Heat of Formation -671.7 ± 16.7 kJ·mol−1
Dipole Moment 7.08 ± 1.08 D
Volume 601.21 Å 3
Surface Area 430.22 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
Synonyms
  • n-[[3-[(2s)-2-hydroxy-3-[2-[4-(phenylsulfonylamino)phenyl]ethylamino]propoxy]phenyl]methyl]acetamide
InChIKey AWIONHVPTYTSHZ-DEOSSOPVSA-N
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