
 CHEMBL130452

 62 65  0  0  0  0  0  0  0  0999 V2000
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   13.0194  -13.4937   -2.6340 Br  0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL130452

>  <PubChem CID>
10627456

>  <Formula>
C27H25BrCl2N4O3

>  <Molecular Weight>
604.326000

>  <IUPAC Name>
N-[2-[3-[(3-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)oxymethyl]-2,4-dichloro-N-methylanilino]-2-oxoethyl]-3-phenylpropanamide

>  <XlogP>
6.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC1=C(N2C=CC=C(C2=N1)OCC3=C(C=CC(=C3Cl)N(C)C(=O)CNC(=O)CCC4=CC=CC=C4)Cl)Br

>  <Isomeric SMILES>
CC1=C(N2C=CC=C(C2=N1)OCC3=C(C=CC(=C3Cl)N(C)C(=O)CNC(=O)CCC4=CC=CC=C4)Cl)Br

>  <InChI Std. ID>
InChI=1S/C27H25BrCl2N4O3/c1-17-26(28)34-14-6-9-22(27(34)32-17)37-16-19-20(29)11-12-21(25(19)30)33(2)24(36)15-31-23(35)13-10-18-7-4-3-5-8-18/h3-9,11-12,14H,10,13,15-16H2,1-2H3,(H,31,35)

>  <InChI Key>
HIZNOBLLOMVFHX-UHFFFAOYSA-N

