
 CHEMBL388234

 79 82  0  0  0  0  0  0  0  0999 V2000
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    6.4037    4.4858    3.7904 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL388234

>  <PubChem CID>
44427407

>  <Formula>
C33H41N3O2

>  <Molecular Weight>
511.710000

>  <IUPAC Name>
N-[5-[1-[3-[(2,2-diphenylacetyl)amino]propyl]piperidin-4-yl]-2-methylphenyl]-2-methylpropanamide

>  <XlogP>
6.0

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC1=C(C=C(C=C1)C2CCN(CC2)CCCNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C(C)C

>  <Isomeric SMILES>
CC1=C(C=C(C=C1)C2CCN(CC2)CCCNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C(C)C

>  <InChI Std. ID>
InChI=1S/C33H41N3O2/c1-24(2)32(37)35-30-23-29(16-15-25(30)3)26-17-21-36(22-18-26)20-10-19-34-33(38)31(27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-16,23-24,26,31H,10,17-22H2,1-3H3,(H,34,38)(H,35,37)

>  <InChI Key>
GMRMXYCDJXDFFA-UHFFFAOYSA-N

