Base information

Cat. No.
CAS No.1196070-26-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C38H44N3NaO4S
Molecular Weight 661.828
Exact Mass 661.295
XLogP3 9.0891
Mr 188.955
PSA 111.77
Sequence -
Atom number 91
Bond number 94
Ring number 5
Rotor number 13
Residues number 0
Canonical smiles CCOc1ccc(cn1)c1ccc(cc1)Cn1c(CC(C(=O)O)(C)C)c(c2c1ccc(c2)OCc1ccc(cn1)C)SC(C)(C)C.[NaH]

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