4-[({1-[(5-Chloro-2-Methoxyphenyl)Sulfonyl]-4-Methyl-2,3-Dihydro-1H-Indol-6-Yl}Carbonyl)Amino]Benzoic Acid

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Properties Simple | Detailed

Formula C24H21ClN2O6S
IUPAC Name 4-[[(1s)-1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-methyl-indoline-6-carbonyl]amino]benzoic acid
Molecular Mass 500.951 g·mol−1
Heat of Formation -810.9 ± 16.7 kJ·mol−1
Dipole Moment 6.85 ± 1.08 D
Volume 538.78 Å 3
Surface Area 456.2 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[[1-(5-chloro-2-methoxy-phenyl)sulfonyl-4-methyl-2,3-dihydroindol-6-yl]carbonylamino]benzoic acid
  • 4-[[1-(5-chloro-2-methoxyphenyl)sulfonyl-4-methyl2,3-dihydroindole-6-carbonyl]amino]benzoic acid
  • 4-[[[1-(5-chloro-2-methoxyphenyl)sulfonyl-4-methyl-6-indolinyl]-oxomethyl]amino]benzoic acid
InChIKey AFPOJEVGADOZQT-UHFFFAOYSA-N
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