(4R)-8-{[(4-Chlorophenyl)Sulfonyl]Amino}-4-[3-(3-Pyridinyl)Propyl]Octanoic Acid

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Formula C22H29ClN2O4S
IUPAC Name (4r)-8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]octanoic acid
Molecular Mass 452.995 g·mol−1
Heat of Formation -723.8 ± 16.7 kJ·mol−1
Dipole Moment 5.34 ± 1.08 D
Volume 547.78 Å 3
Surface Area 428.03 Å 2
HOMO Energy -9.81 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • (4r)-8-[(4-chlorophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoic acid
  • (4r)-8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]caprylic acid
  • (4r)-8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]octanoic acid
InChIKey ISMHAZMNDUAHLK-SFHVURJKSA-N
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Elements C Cl H O N S