
 SCHEMBL931445

 59 63  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL931445

>  <PubChem CID>
59636730

>  <Formula>
C24H28N4O3

>  <Molecular Weight>
420.513000

>  <IUPAC Name>
azetidin-1-yl-[7-[4-[2-(6-methoxypyridin-2-yl)ethyl]piperazin-1-yl]-1-benzofuran-2-yl]methanone

>  <XlogP>
3.4

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
COC1=CC=CC(=N1)CCN2CCN(CC2)C3=CC=CC4=C3OC(=C4)C(=O)N5CCC5

>  <Isomeric SMILES>
COC1=CC=CC(=N1)CCN2CCN(CC2)C3=CC=CC4=C3OC(=C4)C(=O)N5CCC5

>  <InChI Std. ID>
InChI=1S/C24H28N4O3/c1-30-22-8-3-6-19(25-22)9-12-26-13-15-27(16-14-26)20-7-2-5-18-17-21(31-23(18)20)24(29)28-10-4-11-28/h2-3,5-8,17H,4,9-16H2,1H3

>  <InChI Key>
CIWOESWFVHEUMU-UHFFFAOYSA-N

