
 SCHEMBL932014

 64 68  0  0  0  0  0  0  0  0999 V2000
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    9.5076   10.2668    0.1580 H   0  0  0  0  0
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M  END

>  <Chemical Name>
SCHEMBL932014

>  <PubChem CID>
59636726

>  <Formula>
C26H30N6O2

>  <Molecular Weight>
458.566000

>  <IUPAC Name>
N-[2-(1-methylimidazol-4-yl)ethyl]-7-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]-1-benzofuran-2-carboxamide

>  <XlogP>
2.9

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CN1C=C(N=C1)CCNC(=O)C2=CC3=C(O2)C(=CC=C3)N4CCN(CC4)CCC5=CC=CC=N5

>  <Isomeric SMILES>
CN1C=C(N=C1)CCNC(=O)C2=CC3=C(O2)C(=CC=C3)N4CCN(CC4)CCC5=CC=CC=N5

>  <InChI Std. ID>
InChI=1S/C26H30N6O2/c1-30-18-22(29-19-30)8-11-28-26(33)24-17-20-5-4-7-23(25(20)34-24)32-15-13-31(14-16-32)12-9-21-6-2-3-10-27-21/h2-7,10,17-19H,8-9,11-16H2,1H3,(H,28,33)

>  <InChI Key>
DSUAZJYMKNDROE-UHFFFAOYSA-N

