Base information

Cat. No.
CAS No.1536648-98-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H12BrN3O2
Molecular Weight 310.147
Exact Mass 309.011
XLogP3 2.5149
Mr 70.1115
PSA 57.01
Sequence -
Atom number 30
Bond number 31
Ring number 2
Rotor number 4
Residues number 0
Canonical smiles Cc1c(cnn1c1cccc(n1)Br)C(=O)OCC

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