
 SCHEMBL5428753

 70 74  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL5428753

>  <PubChem CID>
69437633

>  <Formula>
C27H37N5O

>  <Molecular Weight>
447.627000

>  <IUPAC Name>
N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-4-[(2,5,7-trimethylimidazo[4,5-b]pyridin-3-yl)methyl]aniline

>  <XlogP>
4.6

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CC1=CC(=NC2=C1N=C(N2CC3=CC=C(C=C3)NCC4CCN(CC4)C5CCOCC5)C)C

>  <Isomeric SMILES>
CC1=CC(=NC2=C1N=C(N2CC3=CC=C(C=C3)NCC4CCN(CC4)C5CCOCC5)C)C

>  <InChI Std. ID>
InChI=1S/C27H37N5O/c1-19-16-20(2)29-27-26(19)30-21(3)32(27)18-23-4-6-24(7-5-23)28-17-22-8-12-31(13-9-22)25-10-14-33-15-11-25/h4-7,16,22,25,28H,8-15,17-18H2,1-3H3

>  <InChI Key>
STVFZAZKWBZRKV-UHFFFAOYSA-N

