Base information

Cat. No.
CAS No.1000895-53-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C13H17N3O2
Molecular Weight 247.293
Exact Mass 247.132
XLogP3 2.3755
Mr 70.2361
PSA 73.16
Sequence -
Atom number 35
Bond number 36
Ring number 2
Rotor number 5
Residues number 0
Canonical smiles COc1cc(CCc2[nH]nc(c2)N)cc(c1)OC

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