(2R)-2-[(2-Amino-1,3-Thiazol-4-Yl)Methyl]-N~1~-{(1S,2S)-3-Cyclohexyl-1-Hydroxy-1-[(3S)-1,5,5-Trimethyl-2-Oxo-3-Pyrrolidinyl]-2-Propanyl}-N~4~-[2-(Dimethylamino)-2-Oxoethyl]-N~4~-[(1S)-1-Phenylethyl]Succinamide

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Properties Simple | Detailed

Formula C36H54N6O5S
IUPAC Name (2r)-2-[(2-aminothiazol-4-yl)methyl]-n-[(1s,2s)-1-(cyclohexylmethyl)-2-hydroxy-2-[(3s)-1,5,5-trimethyl-2-oxo-pyrrolidin-3-yl]ethyl]-n'-[2-(dimethylamino)-2-oxo-ethyl]-n'-[(1s)-1-phenylethyl]butanediamide
Molecular Mass 682.916 g·mol−1
Heat of Formation -957.1 ± 16.7 kJ·mol−1
Dipole Moment 6.98 ± 1.08 D
Volume 861.96 Å 3
Surface Area 645.97 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-[(2-amino-1,3-thiazol-4-yl)methyl]-n-[(1s,2s)-3-cyclohexyl-1-hydroxy-1-[(3s)-1,5,5-trimethyl-2-oxo-pyrrolidin-3-yl]propan-2-yl]-n'-(2-dimethylamino-2-oxo-ethyl)-n'-[(1s)-1-phenylethyl]butanediamide
  • (2r)-2-[(2-amino-1,3-thiazol-4-yl)methyl]-n-[(1s,2s)-3-cyclohexyl-1-hydroxy-1-[(3s)-1,5,5-trimethyl-2-oxopyrrolidin-3-yl]propan-2-yl]-n'-(2-dimethylamino-2-oxoethyl)-n'-[(1s)-1-phenylethyl]butanediamide
  • (2r)-2-[(2-amino-4-thiazolyl)methyl]-n-[(1s,2s)-1-(cyclohexylmethyl)-2-hydroxy-2-[(3s)-1,5,5-trimethyl-2-oxo-3-pyrrolidinyl]ethyl]-n'-(2-dimethylamino-2-oxoethyl)-n'-[(1s)-1-phenylethyl]butanediamide
  • (2r)-2-[(2-aminothiazol-4-yl)methyl]-n-[(1s,2s)-1-(cyclohexylmethyl)-2-hydroxy-2-[(3s)-1,5,5-trimethyl-2-oxo-pyrrolidin-3-yl]ethyl]-n'-(2-dimethylamino-2-oxo-ethyl)-n'-[(1s)-1-phenylethyl]butanediamide
  • (2r)-2-[(2-aminothiazol-4-yl)methyl]-n-[(1s,2s)-1-(cyclohexylmethyl)-2-hydroxy-2-[(3s)-2-keto-1,5,5-trimethyl-pyrrolidin-3-yl]ethyl]-n'-(2-dimethylamino-2-keto-ethyl)-n'-[(1s)-1-phenylethyl]succinamide
  • dmf-phc-hii-cha-ip4
InChIKey IFJSAOFSWZWPQF-SQMKVVGDSA-N
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