5-[4-Phenyl-5-(Trifluoromethyl)-2-Thienyl]-3-[3-(Trifluoromethyl)Phenyl]-1,2,4-Oxadiazole

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Properties Simple | Detailed

Formula C20H10F6N2OS
IUPAC Name 5-[4-phenyl-5-(trifluoromethyl)-2-thienyl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Molecular Mass 440.362 g·mol−1
Heat of Formation -889.4 ± 16.7 kJ·mol−1
Dipole Moment 0.75 ± 1.08 D
Volume 441.18 Å 3
Surface Area 393.83 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy -2.08 ± eV
Point Group Symmetry Cs
Synonyms
  • 5-(4-phenyl-5-(trifluoromethyl)thiophen-2-yl)-3-(3-(trifluoromethyl)phenyl)-1,2,4-oxadiazole
  • 5-(4-phenyl-5-trifluoromethylthiophen-2-yl)-3-(3-trifluoromethylphenyl)-(1,2,4)-oxadiazole
  • 5-[4-phenyl-5-(trifluoromethyl)-2-thienyl]-3-[3-(trifluoromethyl)phenyl]- 1,2,4-oxadiazole
  • 5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
  • s1p<sub>1</sub> receptor agonist, sew2871
  • sew 02871
  • sew-2871
  • sew2871
  • sphingosine-1-phosphate<sub>1</sub> receptor s1p1 agonist
  • sr-01000695417-1
  • sw2871
InChIKey OYMNPJXKQVTQTR-UHFFFAOYSA-N
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