
 CHEMBL171294

 67 71  0  0  0  0  0  0  0  0999 V2000
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M  END

>  <Chemical Name>
CHEMBL171294

>  <PubChem CID>
10767781

>  <Formula>
C27H30N6O4

>  <Molecular Weight>
502.575000

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

>  <XlogP>
2.5

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
7

>  <Canonical SMILES>
CC1=NC2=C(N1C3CCN(CC3)CC(=O)C4=CN(C5=CC=CC(=C54)C(=O)OC)C(=O)N(C)C)C=CN=C2

>  <Isomeric SMILES>
CC1=NC2=C(N1C3CCN(CC3)CC(=O)C4=CN(C5=CC=CC(=C54)C(=O)OC)C(=O)N(C)C)C=CN=C2

>  <InChI Std. ID>
InChI=1S/C27H30N6O4/c1-17-29-21-14-28-11-8-22(21)33(17)18-9-12-31(13-10-18)16-24(34)20-15-32(27(36)30(2)3)23-7-5-6-19(25(20)23)26(35)37-4/h5-8,11,14-15,18H,9-10,12-13,16H2,1-4H3

>  <InChI Key>
GYOXBIRWEXESML-UHFFFAOYSA-N

