Base information

Cat. No.
CAS No.3546-10-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C39H59Cl2NO2
Molecular Weight 644.797
Exact Mass 643.392
XLogP3 10.4663
Mr 191.252
PSA 29.54
Sequence -
Atom number 103
Bond number 107
Ring number 5
Rotor number 14
Residues number 0
Canonical smiles ClCCN(c1ccc(cc1)CC(=O)O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3CC[C@@H]2[C@@H](CCCC(C)C)C)C)C1)C)CCCl

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