Base information

Cat. No.
CAS No.52212-02-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C35H62Br2N4O4
Molecular Weight 762.699
Exact Mass 760.314
XLogP3 -2.5651
Mr 206.937
PSA 59.08
Sequence -
Atom number 107
Bond number 110
Ring number 6
Rotor number 6
Residues number 0
Canonical smiles CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N1CC[N+](CC1)(C)C)C)CC[C@]1([C@H]3C[C@@H]([C@@H]1OC(=O)C)N1CC[N+](CC1)(C)C)C.[Br-].[Br-]

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