Base information

Cat. No.
CAS No.850429-51-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H9BrN2O2
Molecular Weight 245.073
Exact Mass 243.985
XLogP3 2.1842
Mr 52.4279
PSA 65.21
Sequence -
Atom number 22
Bond number 22
Ring number 1
Rotor number 3
Residues number 0
Canonical smiles CCOC(=O)c1cnc(c(c1)Br)N

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