Sb-271,046

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Properties Simple | Detailed

Formula C20H22ClN3O3S2
IUPAC Name 5-chloro-n-(4-methoxy-3-piperazin-1-yl-phenyl)-3-methyl-benzothiophene-2-sulfonamide
Molecular Mass 451.990 g·mol−1
Heat of Formation -253.8 ± 16.7 kJ·mol−1
Dipole Moment 6.27 ± 1.08 D
Volume 492.09 Å 3
Surface Area 345.36 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy -1.39 ± eV
Point Group Symmetry C1
Synonyms
  • 5-chloro-n-(4-methoxy-3-piperazin-1-yl-phenyl)-3-methyl-1-benzothiophene-2-sulfonamide
  • 5-chloro-n-(4-methoxy-3-piperazin-1-yl-phenyl)-3-methyl-benzothiophene-2-sulfonamide
  • 5-chloro-n-(4-methoxy-3-piperazin-1-ylphenyl)-3-methyl-1-benzothiophene-2-sulfonamide
  • 5-chloro-n-[4-methoxy-3-(1-piperazinyl)phenyl]-3-methyl-2-benzothiophenesulfonamide
  • sb271046
InChIKey LOCQRDBFWSXQQI-UHFFFAOYSA-N
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