(2R,4S)-2-{(1R)-2-(Benzylamino)-2-Oxo-1-[(Phenylacetyl)Amino]Ethyl}-N-[(2R)-1-Hydroxy-3-Phenyl-2-Propanyl]-5,5-Dimethyl-1,3-Thiazolidine-4-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C32H38N4O4S
IUPAC Name (2r,4s)-2-[(1r)-2-(benzylamino)-2-oxo-1-[(2-phenylacetyl)amino]ethyl]-n-[(1r)-1-benzyl-2-hydroxy-ethyl]-5,5-dimethyl-thiazolidine-4-carboxamide
Molecular Mass 574.734 g·mol−1
Heat of Formation -564.3 ± 16.7 kJ·mol−1
Dipole Moment 5.75 ± 1.08 D
Volume 712.08 Å 3
Surface Area 495.01 Å 2
HOMO Energy -8.52 ± 0.55 eV
LUMO Energy 2.94 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,4s)-2-[(1r)-2-(benzylamino)-2-keto-1-[(2-phenylacetyl)amino]ethyl]-n-[(1r)-1-(benzyl)-2-hydroxy-ethyl]-5,5-dimethyl-thiazolidine-4-carboxamide
  • (2r,4s)-n-[(1r)-1-(hydroxymethyl)-2-phenyl-ethyl]-5,5-dimethyl-2-[(1r)-2-oxo-1-[(2-phenylacetyl)amino]-2-(phenylmethylamino)ethyl]thiazolidine-4-carboxamide
  • (2r,4s)-n-[(1r)-1-(hydroxymethyl)-2-phenylethyl]-5,5-dimethyl-2-[(1r)-2-oxo-1-[(1-oxo-2-phenylethyl)amino]-2-(phenylmethylamino)ethyl]-4-thiazolidinecarboxamide
  • (2r,4s)-n-[(2r)-1-hydroxy-3-phenyl-propan-2-yl]-5,5-dimethyl-2-[(1r)-2-oxo-1-(2-phenylethanoylamino)-2-(phenylmethylamino)ethyl]-1,3-thiazolidine-4-carboxamide
  • (2r,4s)-n-[(2r)-1-hydroxy-3-phenylpropan-2-yl]-5,5-dimethyl-2-[(1r)-2-oxo-1-[(2-phenylacetyl)amino]-2-(phenylmethylamino)ethyl]-1,3-thiazolidine-4-carboxamide
  • (2rs,4s)-2-{(1r)-2-(benzylamino)-2-oxo-1-[(phenylacetyl)amino]ethyl}-n-[(1r)-1-benzyl-2-hydroxyethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide
  • 2-(benzylcarbamoyl-phenylacetylamino-methyl)-5,5-dimethyl-thiazolidine-4-carboxylic acid (hydroxymethyl-2-phenylethyl)amide
  • g26
  • gr126045
  • penicillin deriv. 53
InChIKey USQYZVYUUXQZHL-IIHCQYLKSA-N
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