2-[(4Z)-2-[(2R)-2-[(1S)-1-Amino-2-Phenyl-Ethyl]-2-Hydroxy-5H-Thiazol-4-Yl]-4-[(4-Hydroxyphenyl)Methylene]-5-Oxo-Imidazol-1-Yl]Acetic Acid

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Properties Simple | Detailed

Formula C23H22N4O5S
IUPAC Name 2-[(4z)-2-[(2r)-2-[(1s)-1-amino-2-phenyl-ethyl]-2-hydroxy-5h-thiazol-4-yl]-4-[(4-hydroxyphenyl)methylene]-5-oxo-imidazol-1-yl]acetic acid
Molecular Mass 466.510 g·mol−1
Heat of Formation -431.9 ± 16.7 kJ·mol−1
Dipole Moment 5.30 ± 1.08 D
Volume 529.06 Å 3
Surface Area 449.72 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -2.09 ± eV
Point Group Symmetry C1
InChIKey XPQLTRRXETWBBT-IGJXYHSOSA-N
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