Base information

Cat. No.
CAS No.60477-38-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C15H13N3O2S
Molecular Weight 299.348
Exact Mass 299.073
XLogP3 4.373
Mr 84.759
PSA 91.36
Sequence -
Atom number 34
Bond number 37
Ring number 4
Rotor number 2
Residues number 0
Canonical smiles [O-][N+](=O)c1ccc(cc1)c1cn2c(n1)sc1c2CCCC1

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