(3R,5R)-7-[2-(4-Fluorophenyl)-5-Isopropyl-4-(4-Morpholinylsulfonyl)-3-Phenyl-1H-Pyrrol-1-Yl]-3,5-Dihydroxyheptanoic Acid

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Properties Simple | Detailed

Formula C30H37FN2O7S
IUPAC Name (3r,5r)-7-[2-(4-fluorophenyl)-5-isopropyl-4-morpholinosulfonyl-3-phenyl-pyrrol-1-yl]-3,5-dihydroxy-heptanoic acid
Molecular Mass 588.687 g·mol−1
Heat of Formation -1364.5 ± 16.7 kJ·mol−1
Dipole Moment 6.27 ± 1.08 D
Volume 680.53 Å 3
Surface Area 525.49 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy 2.49 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,5r)-7-[2-(4-fluorophenyl)-4-morpholin-4-ylsulfonyl-3-phenyl-5-propan-2-yl-pyrrol-1-yl]-3,5-dihydroxy-heptanoic acid
  • (3r,5r)-7-[2-(4-fluorophenyl)-4-morpholin-4-ylsulfonyl-3-phenyl-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoic acid
  • (3r,5r)-7-[2-(4-fluorophenyl)-5-isopropyl-4-morpholinosulfonyl-3-phenyl-1-pyrrolyl]-3,5-dihydroxyheptanoic acid
  • (3r,5r)-7-[2-(4-fluorophenyl)-5-isopropyl-4-morpholinosulfonyl-3-phenyl-pyrrol-1-yl]-3,5-dihydroxy-enanthic acid
  • (3r,5r)-7-[2-(4-fluorophenyl)-5-isopropyl-4-morpholinosulfonyl-3-phenyl-pyrrol-1-yl]-3,5-dihydroxy-heptanoic acid
InChIKey XLVZRBHNHHAPDT-JWQCQUIFSA-N
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