
 CHEMBL124642

 58 60  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL124642

>  <PubChem CID>
10690216

>  <Formula>
C23H31N3O

>  <Molecular Weight>
365.521000

>  <IUPAC Name>
N,N-diethyl-4-[(4-methylpiperazin-1-yl)-phenylmethyl]benzamide

>  <XlogP>
3.5

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCN(CC3)C

>  <Isomeric SMILES>
CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC=CC=C2)N3CCN(CC3)C

>  <InChI Std. ID>
InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-13-11-20(12-14-21)22(19-9-7-6-8-10-19)26-17-15-24(3)16-18-26/h6-14,22H,4-5,15-18H2,1-3H3

>  <InChI Key>
ADYWDZJRWKEHMW-UHFFFAOYSA-N

