Base information

Cat. No.
CAS No.72-57-1
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C34H24N6Na4O14S4
Molecular Weight 960.805
Exact Mass 959.982
XLogP3 10.7852
Mr 202.942
PSA 404.26
Sequence -
Atom number 86
Bond number 87
Ring number 6
Rotor number 9
Residues number 0
Canonical smiles Cc1cc(ccc1/N=N/c1c(O)c2c(N)cc(cc2cc1S(=O)(=O)[O-])S(=O)(=O)[O-])c1ccc(c(c1)C)/N=N/c1c(O)c2c(N)cc(cc2cc1S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

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