N-[2-(Methoxycarbonyl)Phenyl]-O-[2-(5-Methyl-2-Phenyl-1,3-Oxazol-4-Yl)Ethyl]-L-Tyrosine

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Properties Simple | Detailed

Formula C25H16N2O6
IUPAC Name (2s)-2-[(2-methoxycarbonylphenyl)amino]-3-[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]propanoic acid
Molecular Mass 440.404 g·mol−1
Heat of Formation -694.0 ± 16.7 kJ·mol−1
Dipole Moment 4.79 ± 1.08 D
Volume 602.67 Å 3
Surface Area 487.73 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[(2-carbomethoxyphenyl)amino]-3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]propionic acid
  • (2s)-2-[(2-methoxycarbonylphenyl)amino]-3-[4-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]propanoic acid
  • (2s)-2-[(2-methoxycarbonylphenyl)amino]-3-[4-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]propanoic acid
InChIKey KEGOAFNIGUBYHZ-SANMLTNESA-N
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