Base information

Cat. No.
CAS No.1120341-58-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C21H25N5O4S
Molecular Weight 443.519
Exact Mass 443.163
XLogP3 4.4227
Mr 128.776
PSA 124.14
Sequence -
Atom number 56
Bond number 59
Ring number 4
Rotor number 7
Residues number 0
Canonical smiles O=C(N1CCN(CC1)Cc1csc2n1cc(n2)c1ccccc1[N+](=O)[O-])OC(C)(C)C

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