
 CHEMBL1783826

 65 68  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL1783826

>  <PubChem CID>
25001412

>  <Formula>
C26H33Cl2N3O

>  <Molecular Weight>
474.470000

>  <IUPAC Name>
(2R)-1-benzyl-N-[3-[4-(2,6-dichlorophenyl)piperidin-1-yl]propyl]pyrrolidine-2-carboxamide

>  <XlogP>
5.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
C1CC(N(C1)CC2=CC=CC=C2)C(=O)NCCCN3CCC(CC3)C4=C(C=CC=C4Cl)Cl

>  <Isomeric SMILES>
C1C[C@@H](N(C1)CC2=CC=CC=C2)C(=O)NCCCN3CCC(CC3)C4=C(C=CC=C4Cl)Cl

>  <InChI Std. ID>
InChI=1S/C26H33Cl2N3O/c27-22-9-4-10-23(28)25(22)21-12-17-30(18-13-21)15-6-14-29-26(32)24-11-5-16-31(24)19-20-7-2-1-3-8-20/h1-4,7-10,21,24H,5-6,11-19H2,(H,29,32)/t24-/m1/s1

>  <InChI Key>
UWHDLFOAIARROU-XMMPIXPASA-N

