Methyl N-[(4-Methylphenyl)Sulfonyl]Glycyl-3-Carbamimidoyl-L-Phenylalaninate

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Properties Simple | Detailed

Formula C20H24N4O5S
IUPAC Name [azaniumylidene-[3-[(2s)-3-methoxy-3-oxo-2-[[2-(p-tolylsulfonylamino)acetyl]amino]propyl]phenyl]methyl]azanide
Molecular Mass 432.493 g·mol−1
Heat of Formation -695.7 ± 16.7 kJ·mol−1
Dipole Moment 9.42 ± 1.08 D
Volume 503.09 Å 3
Surface Area 362.65 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3-(3-amidinophenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]propionic acid methyl ester
  • (2s)-3-(3-carbamimidoylphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]propanoic acid methyl ester
  • anh
  • l-phenylalanine, 3-(aminoiminomethyl)-n-(n-((4-methylphenyl)sulfonyl)glycyl)-, methyl ester
  • methyl (2s)-3-(3-carbamimidoylphenyl)-2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]propanoate
  • methyl (2s)-3-(3-carbamimidoylphenyl)-2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]propanoate
  • methyl n-[(4-methylphenyl)sulfonyl]glycyl-3-[amino(imino)methyl]-d-phenylalaninate
  • n(alpha)-tosylglycyl-3-amidinophenylalanine methyl ester
  • n-tapam
  • nalpha-(2-naphthylsulfonylglycyl)-3-amidino-d,l-phenylalanine-isopropylester
CAS Number(s)
  • 133397-81-6
InChIKey YAEIKQDHLCFGAA-KRWDZBQOSA-N
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