
 MLS003124182

 50 53  0  0  0  0  0  0  0  0999 V2000
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    2.3139    0.4843   -0.4697 C   0  0  0  0  0
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    3.2817    1.0088    0.3627 N   0  0  0  0  0
    4.6472    1.0314    0.1791 C   0  0  0  0  0
    5.3046    0.6579   -0.9346 C   0  0  0  0  0
    6.7632    0.7053   -1.0320 C   0  0  0  0  0
    7.4584    1.1514    0.0334 C   0  0  0  0  0
    6.7894    1.5229    1.2023 N   0  0  0  0  0
    5.3985    1.5104    1.3011 C   0  0  0  0  0
    4.9785    1.9679    2.4635 N   0  0  0  0  0
    6.1210    2.2538    3.1570 C   0  0  0  0  0
    7.2705    1.9705    2.4317 C   0  0  0  0  0
    8.6724    2.1119    2.8477 C   0  0  0  0  0
    9.0463    3.1752    3.6854 C   0  0  0  0  0
   10.3652    3.3173    4.1269 C   0  0  0  0  0
   11.3353    2.4026    3.7288 C   0  0  0  0  0
   10.9814    1.3356    2.9081 C   0  0  0  0  0
    9.6561    1.1812    2.4864 C   0  0  0  0  0
    7.5015    0.3307   -2.2565 C   0  0  0  0  0
    7.6787    1.3381   -3.2231 C   0  0  0  0  0
    8.3988    1.0893   -4.3886 C   0  0  0  0  0
    8.9470   -0.1690   -4.6018 C   0  0  0  0  0
    8.7688   -1.1820   -3.6546 C   0  0  0  0  0
    8.0454   -0.9635   -2.4660 C   0  0  0  0  0
    7.8407   -2.0017   -1.5214 N   0  0  0  0  0
    6.5475   -2.6648   -1.7444 C   0  0  0  0  0
    8.9500   -2.9436   -1.3565 C   0  0  0  0  0
    0.6422    1.7616   -0.1047 H   0  0  0  0  0
    0.8620    0.4741    1.1187 H   0  0  0  0  0
    0.2169    0.0731   -0.4836 H   0  0  0  0  0
    2.9859    1.3858    1.2609 H   0  0  0  0  0
    4.7816    0.3023   -1.8165 H   0  0  0  0  0
    8.5361    1.2406    0.0166 H   0  0  0  0  0
    6.0685    2.6370    4.1687 H   0  0  0  0  0
    8.3121    3.9098    4.0083 H   0  0  0  0  0
   10.6324    4.1428    4.7825 H   0  0  0  0  0
   12.3624    2.5145    4.0657 H   0  0  0  0  0
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    9.4092    0.3079    1.8877 H   0  0  0  0  0
    7.2562    2.3280   -3.0633 H   0  0  0  0  0
    8.5301    1.8762   -5.1261 H   0  0  0  0  0
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    9.0171   -3.6517   -2.1903 H   0  0  0  0  0
    8.7992   -3.5270   -0.4413 H   0  0  0  0  0
    9.9064   -2.4195   -1.2482 H   0  0  0  0  0
  1  2  1  0  0  0
  1 29  1  0  0  0
  1 30  1  0  0  0
  1 31  1  0  0  0
  2  4  1  0  0  0
  2  3  2  0  0  0
  4  5  1  0  0  0
  4 32  1  0  0  0
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  5 10  1  0  0  0
  6  7  1  0  0  0
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M  END

>  <Chemical Name>
MLS003124182

>  <PubChem CID>
49789721

>  <Formula>
C23H22N4O

>  <Molecular Weight>
370.456000

>  <IUPAC Name>
N-[6-[2-(dimethylamino)phenyl]-3-phenylimidazo[1,2-a]pyridin-8-yl]acetamide

>  <XlogP>
4.3

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC(=O)NC1=CC(=CN2C1=NC=C2C3=CC=CC=C3)C4=CC=CC=C4N(C)C

>  <Isomeric SMILES>
CC(=O)NC1=CC(=CN2C1=NC=C2C3=CC=CC=C3)C4=CC=CC=C4N(C)C

>  <InChI Std. ID>
InChI=1S/C23H22N4O/c1-16(28)25-20-13-18(19-11-7-8-12-21(19)26(2)3)15-27-22(14-24-23(20)27)17-9-5-4-6-10-17/h4-15H,1-3H3,(H,25,28)

>  <InChI Key>
AHAQUYPPTMSFOL-UHFFFAOYSA-N

