Cas no 19525-53-2 (Benzyl 2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetate)

Benzyl 2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetate structure
19525-53-2 structure
Product Name:Benzyl 2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetate
CAS No:19525-53-2
MF:C19H20N2O5
MW:356.372505187988
CID:908188
PubChem ID:297859
Update Time:2025-04-19

Benzyl 2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetate Chemical and Physical Properties

Names and Identifiers

    • Benzyl 2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetate
    • (N-Benzyloxycarbonyl-glycyl)-glycin-benzylester
    • AC1L6S98
    • benzyl N-[(benzyloxy)carbonyl]glycylglycinate
    • Benzyloxycarbonyl-glycyl-glycin-benzylester
    • Cbz-Gly-Gly-OBn
    • N-(N-Benzyloxycarbonyl-glycyl)-glycin-benzylester
    • N-(N-benzyloxycarbonyl-glycyl)-glycine benzyl ester
    • NSC169161
    • Z-Gly-Gly-benzylester
    • Z-Gly-Gly-OBzl
    • NSC-169161
    • 19525-53-2
    • DTXSID30305116
    • Inchi: 1S/C19H20N2O5/c22-17(11-21-19(24)26-14-16-9-5-2-6-10-16)20-12-18(23)25-13-15-7-3-1-4-8-15/h1-10H,11-14H2,(H,20,22)(H,21,24)
    • InChI Key: RJPFPZFBPGTARO-UHFFFAOYSA-N
    • SMILES: O(C(CNC(CNC(=O)OCC1C=CC=CC=1)=O)=O)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 356.1373
  • Monoisotopic Mass: 356.13722174g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 10
  • Complexity: 457
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.2
  • Topological Polar Surface Area: 93.7?2

Experimental Properties

  • PSA: 93.73
  • LogP: 2.55420
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