(4R)-3-{(2S,3S)-2-Hydroxy-3-[(3-Hydroxy-2-Methylbenzoyl)Amino]-4-Phenylbutanoyl}-5,5-Dimethyl-N-(2-Methylbenzyl)-1,3-Thiazolidine-4-Carboxamide

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Properties Simple | Detailed

Formula C32H37N3O5S
IUPAC Name (4r)-3-[(2s,3s)-2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-5,5-dimethyl-n-(o-tolylmethyl)thiazolidine-4-carboxamide
Molecular Mass 575.718 g·mol−1
Heat of Formation -707.6 ± 16.7 kJ·mol−1
Dipole Moment 2.73 ± 1.08 D
Volume 712.49 Å 3
Surface Area 534.78 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy -0.41 ± eV
Point Group Symmetry C1
Synonyms
  • (4r)-3-[(2s,3s)-2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-5,5-dimethyl-n-(2-methylbenzyl)thiazolidine-4-carboxamide
  • (4r)-3-[(2s,3s)-2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]-5,5-dimethyl-n-[(2-methylphenyl)methyl]thiazolidine-4-carboxamide
  • (4r)-3-[(2s,3s)-2-hydroxy-3-[(3-hydroxy-2-methyl-phenyl)carbonylamino]-4-phenyl-butanoyl]-5,5-dimethyl-n-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
  • (4r)-3-[(2s,3s)-2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-5,5-dimethyl-n-[(2-methylphenyl)methyl]-4-thiazolidinecarboxamide
  • (r)-n-(2-methylbenzyl)-3-[(2s,3s)-2-hydroxy-3-(3-hydroxy-2-methylbenzoyl)amino-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide
  • 4-thiazolidinecarboxamide, 3-((2s,3s)-2-hydroxy-3-((3-hydroxy-2-methylbenzoyl)amino)-1-oxo-4-phenylbutyl)-5,5-dimethyl-n-((2-methylphenyl)methyl)-, (4r)-
  • 4-thiazolidinecarboxamide, 3-[(2s,3s)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-1-oxo-4-phenylbutyl]-5,5-dimethyl-n-[(2-methylphenyl)methyl]-, (4r)-
  • ag 1776
  • ag1776
  • je-2147
  • je-2147, ag1776, kni-764
  • je2
  • kni-764
  • sm-319777
CAS Number(s)
  • 186538-00-1
InChIKey CUFQBQOBLVLKRF-RZDMPUFOSA-N
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