
 N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(6-oxo-3-phenylpyridazin-1(6H)-yl)acetamide

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M  END

>  <Chemical Name>
N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(6-oxo-3-phenylpyridazin-1(6H)-yl)acetamide

>  <PubChem CID>
3243537

>  <Formula>
C25H29N5O2

>  <Molecular Weight>
431.540000

>  <IUPAC Name>
N-[2-(4-benzylpiperazin-1-yl)ethyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

>  <XlogP>
2.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CN(CCN1CCNC(=O)CN2C(=O)C=CC(=N2)C3=CC=CC=C3)CC4=CC=CC=C4

>  <Isomeric SMILES>
C1CN(CCN1CCNC(=O)CN2C(=O)C=CC(=N2)C3=CC=CC=C3)CC4=CC=CC=C4

>  <InChI Std. ID>
InChI=1S/C25H29N5O2/c31-24(20-30-25(32)12-11-23(27-30)22-9-5-2-6-10-22)26-13-14-28-15-17-29(18-16-28)19-21-7-3-1-4-8-21/h1-12H,13-20H2,(H,26,31)

>  <InChI Key>
ABCRGCJZNLYEJF-UHFFFAOYSA-N

