(S)-Bepotastine

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Properties Simple | Detailed

Formula C21H25ClN2O3
IUPAC Name 4-[4-[(s)-(4-chlorophenyl)-(2-pyridyl)methoxy]-1-piperidyl]butanoic acid
Molecular Mass 388.888 g·mol−1
Heat of Formation -407.5 ± 16.7 kJ·mol−1
Dipole Moment 5.62 ± 1.08 D
Volume 468.6 Å 3
Surface Area 406.54 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[4-[(s)-(4-chlorophenyl)-(2-pyridyl)methoxy]-1-piperidinyl]butanoic acid
  • 4-[4-[(s)-(4-chlorophenyl)-(2-pyridyl)methoxy]-1-piperidyl]butanoic acid
  • 4-[4-[(s)-(4-chlorophenyl)-(2-pyridyl)methoxy]-1-piperidyl]butyric acid
  • 4-[4-[(s)-(4-chlorophenyl)-pyridin-2-yl-methoxy]piperidin-1-yl]butanoic acid
  • 4-[4-[(s)-(4-chlorophenyl)-pyridin-2-ylmethoxy]piperidin-1-yl]butanoic acid
InChIKey YWGDOWXRIALTES-NRFANRHFSA-N
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Elements H C N O Cl