Base information

Cat. No.
CAS No.147342-57-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C7H7BrN2S
Molecular Weight 231.113
Exact Mass 229.951
XLogP3 2.6425
Mr 53.211
PSA 57.34
Sequence -
Atom number 18
Bond number 17
Ring number 1
Rotor number 2
Residues number 0
Canonical smiles S=C=NCc1cccnc1.Br

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