
 SCHEMBL17334298

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M  END

>  <Chemical Name>
SCHEMBL17334298

>  <PubChem CID>
118575058

>  <Formula>
C21H20ClFN4O2

>  <Molecular Weight>
414.865000

>  <IUPAC Name>
5-(4-chloro-2-fluorophenyl)-2-[(4-methoxy-N-methylanilino)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

>  <XlogP>
3.6

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
CN(CC1=NN2CCN(C(=O)C2=C1)C3=C(C=C(C=C3)Cl)F)C4=CC=C(C=C4)OC

>  <Isomeric SMILES>
CN(CC1=NN2CCN(C(=O)C2=C1)C3=C(C=C(C=C3)Cl)F)C4=CC=C(C=C4)OC

>  <InChI Std. ID>
InChI=1S/C21H20ClFN4O2/c1-25(16-4-6-17(29-2)7-5-16)13-15-12-20-21(28)26(9-10-27(20)24-15)19-8-3-14(22)11-18(19)23/h3-8,11-12H,9-10,13H2,1-2H3

>  <InChI Key>
CSCYKSSEVQRPRP-UHFFFAOYSA-N

