
 FK-453

 53 56  0  0  0  0  0  0  0  0999 V2000
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    1.8806   -5.8661    2.1410 N   0  0  0  0  0
    1.1350   -6.6100    1.2900 N   0  0  0  0  0
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M  END

>  <Chemical Name>
FK-453

>  <PubChem CID>
6439091

>  <Formula>
C23H25N3O2

>  <Molecular Weight>
375.472000

>  <IUPAC Name>
(E)-1-[(2R)-2-(2-hydroxyethyl)piperidin-1-yl]-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)prop-2-en-1-one

>  <XlogP>
3.2

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
C1CCN(C(C1)CCO)C(=O)C=CC2=C3C=CC=CN3N=C2C4=CC=CC=C4

>  <Isomeric SMILES>
C1CCN([C@H](C1)CCO)C(=O)/C=C/C2=C3C=CC=CN3N=C2C4=CC=CC=C4

>  <InChI Std. ID>
InChI=1S/C23H25N3O2/c27-17-14-19-10-4-6-15-25(19)22(28)13-12-20-21-11-5-7-16-26(21)24-23(20)18-8-2-1-3-9-18/h1-3,5,7-9,11-13,16,19,27H,4,6,10,14-15,17H2/b13-12+/t19-/m1/s1

>  <InChI Key>
OPLOPFHUHFGKMJ-JXOMPUQVSA-N

