
 CHEMBL174592

 72 77  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL174592

>  <PubChem CID>
10841126

>  <Formula>
C34H28FN5O4

>  <Molecular Weight>
589.627000

>  <IUPAC Name>
methyl 1-(dimethylcarbamoyl)-6-(4-fluorophenyl)-3-[4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]benzoyl]indole-4-carboxylate

>  <XlogP>
5.3

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
7

>  <Canonical SMILES>
CC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)C4=CN(C5=CC(=CC(=C54)C(=O)OC)C6=CC=C(C=C6)F)C(=O)N(C)C)C=CN=C2

>  <Isomeric SMILES>
CC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)C4=CN(C5=CC(=CC(=C54)C(=O)OC)C6=CC=C(C=C6)F)C(=O)N(C)C)C=CN=C2

>  <InChI Std. ID>
InChI=1S/C34H28FN5O4/c1-20-37-28-17-36-14-13-29(28)39(20)18-21-5-7-23(8-6-21)32(41)27-19-40(34(43)38(2)3)30-16-24(22-9-11-25(35)12-10-22)15-26(31(27)30)33(42)44-4/h5-17,19H,18H2,1-4H3

>  <InChI Key>
CMICIAVRPDZHDE-UHFFFAOYSA-N

