Base information

Cat. No.
CAS No.70750-63-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C70H95CuN9O3S
Molecular Weight 1206.17
Exact Mass 1204.66
XLogP3 15.0326
Mr 370.454
PSA 149.6
Sequence -
Atom number 179
Bond number 187
Ring number 10
Rotor number 35
Residues number 0
Canonical smiles [O-]S(=O)(=O)c1ccc2c(c1)/c/1=N/C3=N/C(=N\c4n5[Cu]n1/c/2=N\C1=N/C(=N\c5c2c4cccc2)/c2c1cccc2)/c1c3cccc1.CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(C)C

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