N-(4-Nitrobenzoyl)-L-Leucyl-N-{4-[(Diaminomethylene)Amino]Butyl}-L-Prolinamide

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Properties Simple | Detailed

Formula C23H35N7O5
IUPAC Name (2s)-n-(4-guanidinobutyl)-1-[(2s)-4-methyl-2-[(4-nitrobenzoyl)amino]pentanoyl]pyrrolidine-2-carboxamide
Molecular Mass 489.568 g·mol−1
Heat of Formation -548.7 ± 16.7 kJ·mol−1
Dipole Moment 4.59 ± 1.08 D
Volume 614.97 Å 3
Surface Area 508.82 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy -1.60 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-n-(4-guanidinobutyl)-1-[(2s)-4-methyl-2-[(4-nitrobenzoyl)amino]pentanoyl]pyrrolidine-2-carboxamide
  • (2s)-n-(4-guanidinobutyl)-1-[(2s)-4-methyl-2-[[(4-nitrophenyl)-oxomethyl]amino]-1-oxopentyl]-2-pyrrolidinecarboxamide
  • (2s)-n-[4-(diaminomethylideneamino)butyl]-1-[(2s)-4-methyl-2-[(4-nitrophenyl)carbonylamino]pentanoyl]pyrrolidine-2-carboxamide
  • 1-guanidino-4-(n-nitro-benzoylamino-l-leucyl-l-prolylamino)butane
  • n-(4-nitrobenzoyl)-l-leucyl-n-(4-{[amino(imino)methyl]amino}butyl)-l-prolinamide
  • ra4
InChIKey FIZYZWLGMGGGBJ-OALUTQOASA-N
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