Base information

Cat. No.
CAS No.552331-43-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C7H4ClN3O
Molecular Weight 181.579
Exact Mass 181.004
XLogP3 0.9715
Mr 45.1687
PSA 58.64
Sequence -
Atom number 16
Bond number 17
Ring number 2
Rotor number 0
Residues number 0
Canonical smiles Clc1ccc2c(n1)nc[nH]c2=O

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