
 SCHEMBL1833847

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M  END

>  <Chemical Name>
SCHEMBL1833847

>  <PubChem CID>
67177962

>  <Formula>
C24H26N6

>  <Molecular Weight>
398.514000

>  <IUPAC Name>
2-[1-(6-benzyl-4,5-dimethylpyridazin-3-yl)piperidin-4-yl]-1H-imidazo[4,5-b]pyridine

>  <XlogP>
4.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CC1=C(C(=NN=C1CC2=CC=CC=C2)N3CCC(CC3)C4=NC5=C(N4)C=CC=N5)C

>  <Isomeric SMILES>
CC1=C(C(=NN=C1CC2=CC=CC=C2)N3CCC(CC3)C4=NC5=C(N4)C=CC=N5)C

>  <InChI Std. ID>
InChI=1S/C24H26N6/c1-16-17(2)24(29-28-21(16)15-18-7-4-3-5-8-18)30-13-10-19(11-14-30)22-26-20-9-6-12-25-23(20)27-22/h3-9,12,19H,10-11,13-15H2,1-2H3,(H,25,26,27)

>  <InChI Key>
BICVVNYZNHJZPZ-UHFFFAOYSA-N

