Cas no 94158-01-7 (4H-Imidazol-4-one,1,1'-(iminodi-2,1-ethanediyl)bis[2-amino-1,5-dihydro- (9CI))

4H-Imidazol-4-one,1,1'-(iminodi-2,1-ethanediyl)bis[2-amino-1,5-dihydro- (9CI) structure
94158-01-7 structure
Product Name:4H-Imidazol-4-one,1,1'-(iminodi-2,1-ethanediyl)bis[2-amino-1,5-dihydro- (9CI)
CAS No:94158-01-7
MF:C10H17N7O2
MW:267.287680387497
CID:806201
PubChem ID:44154287
Update Time:2025-04-19

4H-Imidazol-4-one,1,1'-(iminodi-2,1-ethanediyl)bis[2-amino-1,5-dihydro- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,1'-(iminodiethane-2,1-diyl)bis[2-amino-1,5-dihydro-4H-imidazol-4-one]
    • 2-amino-3-[2-[2-(2-amino-5-oxo-4H-imidazol-3-yl)ethylamino]ethyl]-4H-imidazol-5-one
    • 94158-01-7
    • 1,1'-(Iminodiethane-2,1-diyl)bis(2-amino-1,5-dihydro-4H-imidazol-4-one)
    • DTXSID10240819
    • EINECS 303-070-3
    • 4H-Imidazol-4-one,1,1'-(iminodi-2,1-ethanediyl)bis[2-amino-1,5-dihydro- (9CI)
    • Inchi： 1S/C10H17N7O2/c11-9-14-7(18)5-16(9)3-1-13-2-4-17-6-8(19)15-10(17)12/h13H,1-6H2,(H2,11,14,18)(H2,12,15,19)
    • InChI Key： GATGYMBYAYXMFM-UHFFFAOYSA-N
    • SMILES： O=C1CN(C(N)=N1)CCNCCN1C(N)=NC(C1)=O

Computed Properties

  • Exact Mass: 267.14437281g/mol
  • Monoisotopic Mass: 267.14437281g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 6
  • Complexity: 405
  • 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
  • Surface Charge: 0
  • Tautomer Count: 15
  • XLogP3: -3
  • Topological Polar Surface Area: 129?2

4H-Imidazol-4-one,1,1'-(iminodi-2,1-ethanediyl)bis[2-amino-1,5-dihydro- (9CI) Related Literature

94158-01-7 (4H-Imidazol-4-one,1,1'-(iminodi-2,1-ethanediyl)bis[2-amino-1,5-dihydro- (9CI)) Related Products

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