(3R)-5-{[2-(8-Azaspiro[4.5]Dec-8-Ylcarbonyl)-4,6-Dimethylphenyl]Amino}-3-(1-Naphthyl)-5-Oxopentanoic Acid

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Formula C33H38N2O4
IUPAC Name (3r)-5-[2-(8-azaspiro[4.5]decane-8-carbonyl)-4,6-dimethyl-anilino]-3-(1-naphthyl)-5-oxo-pentanoic acid
Molecular Mass 526.666 g·mol−1
Heat of Formation -678.4 ± 16.7 kJ·mol−1
Dipole Moment 6.27 ± 1.08 D
Volume 655.27 Å 3
Surface Area 500.25 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-5-[[2-(8-azaspiro[4.5]decan-8-yl-oxomethyl)-4,6-dimethylphenyl]amino]-3-(1-naphthyl)-5-oxopentanoic acid
  • (3r)-5-[[2-(8-azaspiro[4.5]decan-8-ylcarbonyl)-4,6-dimethyl-phenyl]amino]-3-naphthalen-1-yl-5-oxo-pentanoic acid
  • (3r)-5-[[2-(8-azaspiro[4.5]decane-8-carbonyl)-4,6-dimethyl-phenyl]amino]-3-(1-naphthyl)-5-oxo-pentanoic acid
  • (3r)-5-[[2-(8-azaspiro[4.5]decane-8-carbonyl)-4,6-dimethyl-phenyl]amino]-5-keto-3-(1-naphthyl)valeric acid
  • cr-2945
InChIKey MFOOVZCXWVAWOV-RUZDIDTESA-N
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