
 SCHEMBL786387

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M  END

>  <Chemical Name>
SCHEMBL786387

>  <PubChem CID>
59504172

>  <Formula>
C28H26F2N2O2

>  <Molecular Weight>
460.525000

>  <IUPAC Name>
1-benzyl-2-cyclopentyl-N-[(3,4-difluorophenyl)methyl]-5-hydroxyindole-3-carboxamide

>  <XlogP>
5.9

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CCC(C1)C2=C(C3=C(N2CC4=CC=CC=C4)C=CC(=C3)O)C(=O)NCC5=CC(=C(C=C5)F)F

>  <Isomeric SMILES>
C1CCC(C1)C2=C(C3=C(N2CC4=CC=CC=C4)C=CC(=C3)O)C(=O)NCC5=CC(=C(C=C5)F)F

>  <InChI Std. ID>
InChI=1S/C28H26F2N2O2/c29-23-12-10-19(14-24(23)30)16-31-28(34)26-22-15-21(33)11-13-25(22)32(17-18-6-2-1-3-7-18)27(26)20-8-4-5-9-20/h1-3,6-7,10-15,20,33H,4-5,8-9,16-17H2,(H,31,34)

>  <InChI Key>
ACJAPISBRPGZRJ-UHFFFAOYSA-N

