N-[(4-Methylphenyl)Sulfonyl]Glycyl-N-{(2S)-5-[(Diaminomethylene)Amino]-2-[(4-Methyl-2-Oxo-2H-Chromen-7-Yl)Amino]Pentanoyl}-L-Prolinamide

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Properties Simple | Detailed

Formula C30H37N7O7S
IUPAC Name (2s)-n-[(2s)-5-amino-2-[(z)-(3-hydroxy-1-methyl-propylidene)amino]pentanoyl]-1-[2-(methanesulfonamido)acetyl]pyrrolidine-2-carboxamide; ammonia; hydrate
Molecular Mass 639.722 g·mol−1
Heat of Formation -1008.4 ± 16.7 kJ·mol−1
Dipole Moment 16.06 ± 1.08 D
Volume 743.27 Å 3
Surface Area 589.96 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-n-[(2s)-5-(diaminomethylideneamino)-2-[(4-methyl-2-oxo-chromen-7-yl)amino]pentanoyl]-1-[2-[(4-methylphenyl)sulfonylamino]ethanoyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-5-(diaminomethylideneamino)-2-[(4-methyl-2-oxochromen-7-yl)amino]pentanoyl]-1-[2-[(4-methylphenyl)sulfonylamino]acetyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-5-guanidino-2-[(2-keto-4-methyl-chromen-7-yl)amino]pentanoyl]-1-[2-[(4-methylphenyl)sulfonylamino]acetyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-5-guanidino-2-[(4-methyl-2-oxo-7-chromenyl)amino]-1-oxopentyl]-1-[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]-2-pyrrolidinecarboxamide
  • (2s)-n-[(2s)-5-guanidino-2-[(4-methyl-2-oxo-chromen-7-yl)amino]pentanoyl]-1-[2-[(4-methylphenyl)sulfonylamino]acetyl]pyrrolidine-2-carboxamide
  • tgpamnh2
  • tos-gly-pro-arg-4-methylcoumaryl-7-nh2
  • tosyl-glycyl-prolyl-arginyl-4-methylcoumaryl-7-amide
CAS Number(s)
  • 117961-27-0
InChIKey PZPDSUNEHIMSSV-ZEQRLZLVSA-N
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