
 BDBM81844

 74 78  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
BDBM81844

>  <PubChem CID>
23626094

>  <Formula>
C28H38N6O2

>  <Molecular Weight>
490.652000

>  <IUPAC Name>
4-[3-[4-(6-methylpyridin-2-yl)piperazine-1-carbonyl]piperidin-1-yl]-N-phenylpiperidine-1-carboxamide

>  <XlogP>
2.900

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CC1=NC(=CC=C1)N2CCN(CC2)C(=O)C3CCCN(C3)C4CCN(CC4)C(=O)NC5=CC=CC=C5

>  <Isomeric SMILES>
CC1=NC(=CC=C1)N2CCN(CC2)C(=O)C3CCCN(C3)C4CCN(CC4)C(=O)NC5=CC=CC=C5

>  <InChI Std. ID>
InChI=1S/C28H38N6O2/c1-22-7-5-11-26(29-22)31-17-19-32(20-18-31)27(35)23-8-6-14-34(21-23)25-12-15-33(16-13-25)28(36)30-24-9-3-2-4-10-24/h2-5,7,9-11,23,25H,6,8,12-21H2,1H3,(H,30,36)

>  <InChI Key>
DLCBBUCWSPAOTB-UHFFFAOYSA-N

