Base information

Cat. No.
CAS No.53092-85-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C51H40Br4Cl2N6Na2O5S2
Molecular Weight 1317.53
Exact Mass 1311.84
XLogP3 5.1766
Mr 302.188
PSA 196.95
Sequence -
Atom number 112
Bond number 115
Ring number 10
Rotor number 4
Residues number 0
Canonical smiles [O-]C(=O)c1ccccc1c1c2cc(Br)c(c(c2oc2-c1cc(Br)c(=O)c2Br)Br)[O-].CN(c1ccc2c(c1)sc1-c(n2)ccc(=[N+](C)C)c1)C.CNc1ccc2c(c1)sc1-c(n2)ccc(=[N+](C)C)c1.[Na+].[Na+].[Cl-].[Cl-]

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