(2S,3S)-1-(4-Methoxyphenyl)-3-{3-[2-(5-Methyl-2-Phenyl-1,3-Oxazol-4-Yl)Ethoxy]Benzyl}-4-Oxo-2-Azetidinecarboxylic Acid

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Properties Simple | Detailed

Formula C30H28N2O6
IUPAC Name (2s,3s)-1-(4-methoxyphenyl)-3-[[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]methyl]-4-oxo-azetidine-2-carboxylic acid
Molecular Mass 512.553 g·mol−1
Heat of Formation -538.1 ± 16.7 kJ·mol−1
Dipole Moment 4.20 ± 1.08 D
Volume 600.2 Å 3
Surface Area 532.53 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy 2.32 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s)-1-(4-methoxyphenyl)-3-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]-4-oxo-azetidine-2-carboxylic acid
  • (2s,3s)-1-(4-methoxyphenyl)-3-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methyl]-4-oxoazetidine-2-carboxylic acid
  • (2s,3s)-1-(4-methoxyphenyl)-3-[[3-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]methyl]-4-oxo-2-azetidinecarboxylic acid
  • (2s,3s)-1-(4-methoxyphenyl)-3-[[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]methyl]-4-oxo-azetidine-2-carboxylic acid
  • (2s,3s)-4-keto-1-(4-methoxyphenyl)-3-[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]benzyl]azetidine-2-carboxylic acid
  • rew
InChIKey DKIUFVFEAUCDLY-BDYUSTAISA-N
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