N~2~-1,3-Benzoxazol-2-Yl-3-Cyclohexyl-N-{2-[(4-Methoxyphenyl)Amino]Ethyl}-L-Alaninamide

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Formula C25H32N4O3
IUPAC Name (2s)-2-(1,3-benzoxazol-2-ylamino)-3-cyclohexyl-n-[2-(4-methoxyanilino)ethyl]propanamide
Molecular Mass 436.547 g·mol−1
Heat of Formation -272.5 ± 16.7 kJ·mol−1
Dipole Moment 2.85 ± 1.08 D
Volume 538.97 Å 3
Surface Area 470.45 Å 2
HOMO Energy -8.08 ± 0.55 eV
LUMO Energy 2.60 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(1,3-benzoxazol-2-ylamino)-3-cyclohexyl-n-[2-[(4-methoxyphenyl)amino]ethyl]propanamide
  • (2s)-2-(1,3-benzoxazol-2-ylamino)-3-cyclohexyl-n-[2-[(4-methoxyphenyl)amino]ethyl]propionamide
  • gnf
InChIKey VFNWTXUFNNOQHD-QFIPXVFZSA-N
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