
 CHEMBL338682

 61 63  0  0  0  0  0  0  0  0999 V2000
    7.5482    4.4150    9.8693 C   0  0  0  0  0
    6.3656    4.5578    8.9239 C   0  0  0  0  0
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    8.8095    5.8135    2.9573 C   0  0  0  0  0
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   12.2816    9.3756   -1.3124 C   0  0  0  0  0
   11.1430    8.7456   -1.8240 C   0  0  0  0  0
   10.4472    7.8192   -1.0535 C   0  0  0  0  0
   13.0856   10.4940   -2.3606 Cl  0  0  0  0  0
   14.0229    9.7294    0.4963 C   0  0  0  0  0
   15.1200    8.9671   -0.0011 O   0  0  0  0  0
   16.3889    9.3592    0.3548 C   0  0  0  0  0
   16.7344   10.1585    1.3904 C   0  0  0  0  0
   18.1223   10.5001    1.6660 C   0  0  0  0  0
   19.0824   10.0199    0.8662 C   0  0  0  0  0
   18.7324    9.2016   -0.2093 N   0  0  0  0  0
   17.4173    8.8389   -0.5019 C   0  0  0  0  0
   17.3672    8.0640   -1.5716 N   0  0  0  0  0
   18.6683    7.9170   -1.9986 C   0  0  0  0  0
   19.5207    8.6068   -1.1647 C   0  0  0  0  0
   21.3783    8.7091   -1.3207 Br  0  0  0  0  0
   18.9666    7.0986   -3.1960 C   0  0  0  0  0
   12.6423    7.6557    2.3160 Cl  0  0  0  0  0
    7.2522    3.8669   10.7690 H   0  0  0  0  0
    7.9260    5.3955   10.1762 H   0  0  0  0  0
    8.3668    3.8666    9.3916 H   0  0  0  0  0
    5.5505    5.0779    9.4400 H   0  0  0  0  0
    5.9977    3.5608    8.6552 H   0  0  0  0  0
    7.6021    4.8213    7.1807 H   0  0  0  0  0
    7.0993    6.3315    7.9392 H   0  0  0  0  0
    4.7464    5.9390    7.1763 H   0  0  0  0  0
    5.2402    4.4348    6.4020 H   0  0  0  0  0
    6.3534    7.2186    5.7216 H   0  0  0  0  0
    5.0718    6.3969    4.8220 H   0  0  0  0  0
    7.7864    7.3482    3.9955 H   0  0  0  0  0
    8.3350    5.0659    2.3192 H   0  0  0  0  0
    9.5794    5.3370    3.5728 H   0  0  0  0  0
    9.1340    4.8350    0.3295 H   0  0  0  0  0
   10.6651    4.5512    1.2007 H   0  0  0  0  0
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   10.7953    8.9712   -2.8299 H   0  0  0  0  0
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   14.1015   10.7697    0.1577 H   0  0  0  0  0
   16.0032   10.5680    2.0777 H   0  0  0  0  0
   18.3472   11.1361    2.5172 H   0  0  0  0  0
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   18.0717    6.9747   -3.8138 H   0  0  0  0  0
   19.3173    6.1056   -2.8987 H   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL338682

>  <PubChem CID>
10555061

>  <Formula>
C24H27BrCl2N4O3

>  <Molecular Weight>
570.309000

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

>  <XlogP>
6.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CCCCCC(=O)NCC(=O)N(C)C1=C(C(=C(C=C1)Cl)COC2=CC=CN3C2=NC(=C3Br)C)Cl

>  <Isomeric SMILES>
CCCCCC(=O)NCC(=O)N(C)C1=C(C(=C(C=C1)Cl)COC2=CC=CN3C2=NC(=C3Br)C)Cl

>  <InChI Std. ID>
InChI=1S/C24H27BrCl2N4O3/c1-4-5-6-9-20(32)28-13-21(33)30(3)18-11-10-17(26)16(22(18)27)14-34-19-8-7-12-31-23(25)15(2)29-24(19)31/h7-8,10-12H,4-6,9,13-14H2,1-3H3,(H,28,32)

>  <InChI Key>
GQHVTRSSDHNDMU-UHFFFAOYSA-N

