Base information

Cat. No.
CAS No.10190-69-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C31H24N5NaO5S3
Molecular Weight 665.738
Exact Mass 665.084
XLogP3 8.7414
Mr 173.634
PSA 215.9
Sequence -
Atom number 69
Bond number 73
Ring number 6
Rotor number 9
Residues number 0
Canonical smiles CC(=O)C(C(=O)Nc1ccccc1)/N=N/c1ccc(cc1)c1sc2c(n1)ccc(c2)c1nc2c(s1)c(c(cc2)C)S(=O)(=O)O.[NaH]

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