
 SCHEMBL931468

 55 59  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL931468

>  <PubChem CID>
59636729

>  <Formula>
C23H26N4O2

>  <Molecular Weight>
390.487000

>  <IUPAC Name>
azetidin-1-yl-[7-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]-1-benzofuran-2-yl]methanone

>  <XlogP>
3.1

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CN(C1)C(=O)C2=CC3=C(O2)C(=CC=C3)N4CCN(CC4)CCC5=CC=CC=N5

>  <Isomeric SMILES>
C1CN(C1)C(=O)C2=CC3=C(O2)C(=CC=C3)N4CCN(CC4)CCC5=CC=CC=N5

>  <InChI Std. ID>
InChI=1S/C23H26N4O2/c28-23(27-10-4-11-27)21-17-18-5-3-7-20(22(18)29-21)26-15-13-25(14-16-26)12-8-19-6-1-2-9-24-19/h1-3,5-7,9,17H,4,8,10-16H2

>  <InChI Key>
ADPQAJXGMQOWHJ-UHFFFAOYSA-N

