N-{[4-(4-Phenyl-1-Piperidinyl)Phenyl]Sulfonyl}-L-Tryptophan

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Properties Simple | Detailed

Formula C28H29N3O4S
IUPAC Name (2s)-3-indol-1-ium-3-yl-2-[[4-(4-phenyl-1-piperidyl)phenyl]sulfonylamino]propanoic acid
Molecular Mass 503.613 g·mol−1
Heat of Formation -410.5 ± 16.7 kJ·mol−1
Dipole Moment 5.61 ± 1.08 D
Volume 583.73 Å 3
Surface Area 438.91 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3-(1h-indol-3-yl)-2-[[4-(4-phenyl-1-piperidinyl)phenyl]sulfonylamino]propanoic acid
  • (2s)-3-(1h-indol-3-yl)-2-[[4-(4-phenyl-1-piperidyl)phenyl]sulfonylamino]propanoic acid
  • (2s)-3-(1h-indol-3-yl)-2-[[4-(4-phenyl-1-piperidyl)phenyl]sulfonylamino]propionic acid
  • (2s)-3-(1h-indol-3-yl)-2-[[4-(4-phenylpiperidin-1-yl)phenyl]sulfonylamino]propanoic acid
InChIKey ULOTXPTWJAUGGE-MHZLTWQESA-N
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