
 LASSBio-670

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M  END

>  <Chemical Name>
LASSBio-670

>  <PubChem CID>
53329445

>  <Formula>
C20H25ClN2O3

>  <Molecular Weight>
376.881000

>  <IUPAC Name>
1-[3-(1,3-benzodioxol-5-yloxy)propyl]-4-phenylpiperazine;hydrochloride

>  <XlogP>
-10000

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CN(CCN1CCCOC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4.Cl

>  <Isomeric SMILES>
C1CN(CCN1CCCOC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4.Cl

>  <InChI Std. ID>
InChI=1S/C20H24N2O3.ClH/c1-2-5-17(6-3-1)22-12-10-21(11-13-22)9-4-14-23-18-7-8-19-20(15-18)25-16-24-19;/h1-3,5-8,15H,4,9-14,16H2;1H

>  <InChI Key>
ORCOFTJWNPGVLN-UHFFFAOYSA-N

