diminazene aceturate

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 75
Total Number of Articles : 93
PubChem 5284544
Molecular Formula

C22H29N9O6

SMILES

CC(=O)NCC(=O)O.CC(=O)NCC(=O)O.C1=CC(=CC=C1C(=N)N)NN=NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C14H15N7.2C4H7NO3/c15-13(16)9-1-5-11(6-2-9)19-21-20-12-7-3-10(4-8-12)14(17)18;2*1-3(6)5-2-4(7)8/h1-8H,(H3,15,16)(H3,17,18)(H,19,20);2*2H2,1H3,(H,5,6)(H,7,8)

synonyms
  • Diminazene aceturate
  • Diminazene diaceturate
  • 908-54-3
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Properties
Property Value
MW 515.5 g/mol
HBD 9
HBA 11
Rotatable Bond Count 9
Exact Mass 515.22407968 g/mol
Monoisotopic Mass 515.22407968 g/mol
Heavy Atom Count 37
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 3
Complexity 500
xlogp None
Topological Polar Surface Area 269