
 SCHEMBL9129857

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M  END

>  <Chemical Name>
SCHEMBL9129857

>  <PubChem CID>
10068354

>  <Formula>
C22H28N4O2

>  <Molecular Weight>
380.492000

>  <IUPAC Name>
tert-butyl N-[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]carbamate

>  <XlogP>
4.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CCC1=NC2=C(N1CC3=CC=C(C=C3)NC(=O)OC(C)(C)C)N=C(C=C2C)C

>  <Isomeric SMILES>
CCC1=NC2=C(N1CC3=CC=C(C=C3)NC(=O)OC(C)(C)C)N=C(C=C2C)C

>  <InChI Std. ID>
InChI=1S/C22H28N4O2/c1-7-18-25-19-14(2)12-15(3)23-20(19)26(18)13-16-8-10-17(11-9-16)24-21(27)28-22(4,5)6/h8-12H,7,13H2,1-6H3,(H,24,27)

>  <InChI Key>
IMCJIYOSGJPSKP-UHFFFAOYSA-N

