Base information

Cat. No.
CAS No.480449-71-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C31H38ClN7O7S2
Molecular Weight 720.259
Exact Mass 719.196
XLogP3 4.4048
Mr 184.505
PSA 227.62
Sequence -
Atom number 86
Bond number 89
Ring number 5
Rotor number 11
Residues number 0
Canonical smiles CN1CCc2c(C1)sc(n2)C(=O)N[C@@H]1C[C@H](CC[C@@H]1NC(=O)C(=O)Nc1ccc(cn1)Cl)C(=O)N(C)C.Cc1ccc(cc1)S(=O)(=O)O

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