
 SCHEMBL1716434

 56 59  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
SCHEMBL1716434

>  <PubChem CID>
25128141

>  <Formula>
C24H25FN4O2

>  <Molecular Weight>
420.488000

>  <IUPAC Name>
[(2R,5R)-5-[(5-fluoropyridin-2-yl)oxymethyl]-2-methylpiperidin-1-yl]-(5-methyl-2-pyrazin-2-ylphenyl)methanone

>  <XlogP>
3.5

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CC1CCC(CN1C(=O)C2=C(C=CC(=C2)C)C3=NC=CN=C3)COC4=NC=C(C=C4)F

>  <Isomeric SMILES>
C[C@@H]1CC[C@H](CN1C(=O)C2=C(C=CC(=C2)C)C3=NC=CN=C3)COC4=NC=C(C=C4)F

>  <InChI Std. ID>
InChI=1S/C24H25FN4O2/c1-16-3-7-20(22-13-26-9-10-27-22)21(11-16)24(30)29-14-18(5-4-17(29)2)15-31-23-8-6-19(25)12-28-23/h3,6-13,17-18H,4-5,14-15H2,1-2H3/t17-,18-/m1/s1

>  <InChI Key>
FXCKYYUAELZRMB-QZTJIDSGSA-N

