(2S)-3-(4-{[2-(4-Chlorophenyl)-1,3-Thiazol-4-Yl]Methoxy}-2-Methylphenyl)-2-Ethoxypropanoic Acid

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Formula C22H22ClNO4S
IUPAC Name (2s)-3-[4-[[2-(4-chlorophenyl)thiazol-4-yl]methoxy]-2-methyl-phenyl]-2-ethoxy-propanoic acid
Molecular Mass 431.932 g·mol−1
Heat of Formation -475.4 ± 16.7 kJ·mol−1
Dipole Moment 2.31 ± 1.08 D
Volume 498.36 Å 3
Surface Area 441.02 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy 1.76 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3-[4-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methoxy]-2-methyl-phenyl]-2-ethoxy-propanoic acid
  • (2s)-3-[4-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methoxy]-2-methylphenyl]-2-ethoxypropanoic acid
  • (2s)-3-[4-[[2-(4-chlorophenyl)-4-thiazolyl]methoxy]-2-methylphenyl]-2-ethoxypropanoic acid
  • (2s)-3-[4-[[2-(4-chlorophenyl)thiazol-4-yl]methoxy]-2-methyl-phenyl]-2-ethoxy-propanoic acid
  • (2s)-3-[4-[[2-(4-chlorophenyl)thiazol-4-yl]methoxy]-2-methyl-phenyl]-2-ethoxy-propionic acid
InChIKey OTUKSARQRIIQDU-FQEVSTJZSA-N
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