N-[4-(2-{[(2R)-2-Hydroxy-2-(3-Pyridinyl)Ethyl]Amino}Ethyl)Phenyl]-4-{4-[4-(Trifluoromethyl)Phenyl]-1,3-Thiazol-2-Yl}Benzenesulfonamide

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Properties Simple | Detailed

Formula C31H27F3N4O3S2
IUPAC Name n-[4-[2-[[(2r)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]thiazol-2-yl]benzenesulfonamide
Molecular Mass 624.696 g·mol−1
Heat of Formation -629.3 ± 16.7 kJ·mol−1
Dipole Moment 6.68 ± 1.08 D
Volume 700.44 Å 3
Surface Area 514.31 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy -1.40 ± eV
Point Group Symmetry C1
Synonyms
  • n-[4-[2-[[(2r)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]-2-thiazolyl]benzenesulfonamide
  • n-[4-[2-[[(2r)-2-hydroxy-2-(3-pyridyl)ethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]thiazol-2-yl]benzenesulfonamide
  • n-[4-[2-[[(2r)-2-hydroxy-2-pyridin-3-yl-ethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]benzenesulfonamide
  • n-[4-[2-[[(2r)-2-hydroxy-2-pyridin-3-ylethyl]amino]ethyl]phenyl]-4-[4-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]benzenesulfonamide
InChIKey MSOUIIHPMJCUNI-LJAQVGFWSA-N
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