(2S)-1-Oxo-1-[(4-Sulfamoylphenyl)Amino]-2-Propanyl (2S)-2-Methyl-1,2,3,4-Tetrahydro-9-Acridinecarboxylate

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Properties Simple | Detailed

Formula C24H25N3O5S
IUPAC Name [(1s)-1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl] (2s)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate
Molecular Mass 467.537 g·mol−1
Heat of Formation -653.8 ± 16.7 kJ·mol−1
Dipole Moment 7.08 ± 1.08 D
Volume 529.54 Å 3
Surface Area 456.51 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [(1s)-1-methyl-2-oxo-2-[(4-sulfamoylphenyl)amino]ethyl] ester
  • (2s)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [(1s)-2-keto-1-methyl-2-[(4-sulfamoylphenyl)amino]ethyl] ester
  • [(1s)-1-methyl-2-oxo-2-[(4-sulfamoylphenyl)amino]ethyl] (2s)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate
  • [(2s)-1-oxo-1-[(4-sulfamoylphenyl)amino]propan-2-yl] (2s)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate
InChIKey ZICDFSXBQFNQBM-GJZGRUSLSA-N
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