Navarixin

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Formula C21H23N3O5
IUPAC Name 2-hydroxy-n,n-dimethyl-3-[[2-[[(1r)-1-(5-methyl-2-furyl)propyl]amino]-3,4-dioxo-cyclobuten-1-yl]amino]benzamide
Molecular Mass 397.424 g·mol−1
Heat of Formation -396.4 ± 16.7 kJ·mol−1
Dipole Moment 10.09 ± 1.08 D
Volume 488.44 Å 3
Surface Area 401.51 Å 2
HOMO Energy -7.80 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxy-n,n-dimethyl-3-[[2-[[(1r)-1-(5-methyl-2-furyl)propyl]amino]-3,4-dioxo-1-cyclobutenyl]amino]benzamide
  • 2-hydroxy-n,n-dimethyl-3-[[2-[[(1r)-1-(5-methylfuran-2-yl)propyl]amino]-3,4-dioxo-1-cyclobutenyl]amino]benzamide
  • 3-[[3,4-diketo-2-[[(1r)-1-(5-methyl-2-furyl)propyl]amino]-1-cyclobutenyl]amino]-2-hydroxy-n,n-dimethyl-benzamide
InChIKey RXIUEIPPLAFSDF-CYBMUJFWSA-N
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