N-[4-(6-Hydroxy-3-{4-[2-(1-Piperidinyl)Ethoxy]Benzoyl}-1-Benzothiophen-2-Yl)Phenyl]-N-(Methylsulfonyl)Methanesulfonamide

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Properties Simple | Detailed

Formula C30H32N2O7S3
IUPAC Name n-[4-[6-hydroxy-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-2-yl]phenyl]-n-methylsulfonyl-methanesulfonamide
Molecular Mass 628.779 g·mol−1
Heat of Formation -930.5 ± 16.7 kJ·mol−1
Dipole Moment 6.08 ± 1.08 D
Volume 703.78 Å 3
Surface Area 529.81 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 2.19 ± eV
Point Group Symmetry C1
Synonyms
  • n-[4-[6-hydroxy-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenyl]-n-methylsulfonylmethanesulfonamide
  • n-[4-[6-hydroxy-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl]-n-methylsulfonyl-methanesulfonamide
  • n-[4-[6-hydroxy-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophen-2-yl]phenyl]-n-mesyl-methanesulfonamide
  • n-[4-[6-hydroxy-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-2-yl]phenyl]-n-methylsulfonyl-methanesulfonamide
  • n-[4-[6-hydroxy-3-[oxo-[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]-2-benzothiophenyl]phenyl]-n-methylsulfonylmethanesulfonamide
InChIKey RSJYPIKEOWEIPQ-UHFFFAOYSA-N
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