5-Oxo-L-Prolyl-L-Prolyl-N~5~-(Diaminomethylene)-N-(4-Nitrophenyl)-L-Ornithinamide

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Properties Simple | Detailed

Formula C22H30N8O6
IUPAC Name (2s)-n-[(1s)-4-guanidino-1-[(4-nitrophenyl)carbamoyl]butyl]-1-[(2s)-5-oxopyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
Molecular Mass 502.524 g·mol−1
Heat of Formation -687.8 ± 16.7 kJ·mol−1
Dipole Moment 11.08 ± 1.08 D
Volume 581.26 Å 3
Surface Area 467.82 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 1.73 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-n-[(1s)-4-guanidino-1-[(4-nitrophenyl)carbamoyl]butyl]-1-[(2s)-5-oxopyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(1s)-4-guanidino-1-[(4-nitrophenyl)carbamoyl]butyl]-1-pyroglutamoyl-pyrrolidine-2-carboxamide
  • (2s)-n-[(1s)-4-guanidino-1-[[(4-nitrophenyl)amino]-oxomethyl]butyl]-1-[oxo-[(2s)-5-oxo-2-pyrrolidinyl]methyl]-2-pyrrolidinecarboxamide
  • (2s)-n-[(2s)-5-(diaminomethylideneamino)-1-[(4-nitrophenyl)amino]-1-oxo-pentan-2-yl]-1-[(2s)-5-oxopyrrolidin-2-yl]carbonyl-pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-5-(diaminomethylideneamino)-1-[(4-nitrophenyl)amino]-1-oxopentan-2-yl]-1-[(2s)-5-oxopyrrolidine-2-carbonyl]pyrrolidine-2-carboxamide
  • l-agrininamide, 5-oxo-l-prolyl-l-prolyl-n-(4-nitrophenyl)-
  • pglu-pro-arg-pna
  • pyroglutamyl-prolyl-arginine-4-nitroanilide
  • s 2366
  • s-2366
CAS Number(s)
  • 72194-57-1
InChIKey WPVINHLVHHPBMK-ULQDDVLXSA-N
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