
 CHEMBL363194

 62 65  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL363194

>  <PubChem CID>
44399520

>  <Formula>
C25H30Cl3N3O

>  <Molecular Weight>
494.885000

>  <IUPAC Name>
2-chloro-N-[[1-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]piperidin-3-yl]methyl]benzamide

>  <XlogP>
6.0

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
C1CC(CN(C1)C2CCN(CC2)CC3=CC(=C(C=C3)Cl)Cl)CNC(=O)C4=CC=CC=C4Cl

>  <Isomeric SMILES>
C1CC(CN(C1)C2CCN(CC2)CC3=CC(=C(C=C3)Cl)Cl)CNC(=O)C4=CC=CC=C4Cl

>  <InChI Std. ID>
InChI=1S/C25H30Cl3N3O/c26-22-6-2-1-5-21(22)25(32)29-15-19-4-3-11-31(17-19)20-9-12-30(13-10-20)16-18-7-8-23(27)24(28)14-18/h1-2,5-8,14,19-20H,3-4,9-13,15-17H2,(H,29,32)

>  <InChI Key>
AAFZVBOPDUKYEG-UHFFFAOYSA-N

