Lopinavir

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Formula C37H48N4O5
IUPAC Name (2s)-n-[(1s,3s,4s)-1-benzyl-4-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-pentyl]-3-methyl-2-(2-oxohexahydropyrimidin-1-yl)butanamide
Molecular Mass 628.801 g·mol−1
Heat of Formation -801.1 ± 16.7 kJ·mol−1
Dipole Moment 6.04 ± 1.08 D
Volume 802.12 Å 3
Surface Area 608.23 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 0.13 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-n-[(1s,3s,4s)-1-(benzyl)-4-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-pentyl]-2-(2-ketohexahydropyrimidin-1-yl)-3-methyl-butyramide
  • (2s)-n-[(1s,3s,4s)-4-[[2-(2,6-dimethylphenoxy)-1-oxoethyl]amino]-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]-3-methyl-2-(2-oxo-1-hexahydropyrimidinyl)butanamide
  • (2s)-n-[(1s,3s,4s)-4-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]-3-methyl-2-(2-oxohexahydropyrimidin-1-yl)butanamide
  • (2s)-n-[(2s,4s,5s)-5-[2-(2,6-dimethylphenoxy)ethanoylamino]-4-hydroxy-1,6-di(phenyl)hexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide
  • (2s)-n-[(2s,4s,5s)-5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-di(phenyl)hexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide
  • (alphas)-tetrahydro-n-((alphas)-alpha-((2s,3s)-2-hydroxy-4-phenyl-3-(2-(2,6-xylyloxy)acetamido)butyl)phenethyl)-alpha-isopropyl-2-oxo-1(2h)-pyrimidineacetamide
  • 1(2h)-pyrimidineacetamide, n-((1s,3s,4s)-4-(((2,6-dimethylphenoxy)acetyl)amino)-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl)tetrahyrdo-alpha-1-methylethyl)-2-oxo-, (alphas)-
  • 1(2h)-pyrimidineacetamide, n-[(1s,3s,4s)-4-[[(2,6-dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]tetrahydro-.alpha.-(1-methylethyl)-2-oxo-, (as)-
  • 1(2h)-pyrimidineacetamide, n-[(1s,3s,4s)-4-[[(2,6-dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]tetrahydro-alpha-(1-methylethyl)-2-oxo-, (alphas)- (9ci)
  • 1(2h)-pyrimidineacetamide, n-[(1s,3s,4s)-4-[[2-(2,6-dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]tetrahydro-alpha-(1-methylethyl)-2-oxo-, (alphas)-
  • 1(2h)-pyrimidineacetamide, n-[4-[[(2,6-dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]tetrahydro-alpha-(1-methylethyl)-2-oxo-, [1s-[1r*(r*),3r*,4r*]]-
  • a 157378
  • a 157378.0
  • ab1
  • abt 378
  • abt-378
  • abt-378, lopinavir
  • aluviran
  • d01425
  • koletra
  • lopinavir (jan/usan)
  • lpv
  • n-{1-benzyl-4-[2-(2,6-dimethyl-phenoxy)-acetylamino]-3-hydroxy-5-phenyl-pentyl}-3-methyl-2-(2-oxo-tetrahydro-pyrimidin-1-yl)-butyramide
  • rs-346
CAS Number(s)
  • 192725-17-0
InChIKey KJHKTHWMRKYKJE-SUGCFTRWSA-N
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