Base information

Cat. No.
CAS No.2097125-58-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C39H40N6O10S
Molecular Weight 784.834
Exact Mass 784.253
XLogP3 5.9189
Mr 211.808
PSA 205.82
Sequence -
Atom number 96
Bond number 101
Ring number 7
Rotor number 12
Residues number 0
Canonical smiles CS(=O)(=O)O.COc1cc(c(cc1OC)NC(=O)c1cc(=O)c2c(o1)cccc2)c1nnn(n1)c1ccc(cc1)CCN1CCc2c(C1)cc(c(c2)OC)OC

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