
 CHEMBL3771335

 43 45  0  0  0  0  0  0  0  0999 V2000
    0.8174   -2.0472   -3.4690 C   0  0  0  0  0
    1.9804   -1.6917   -2.6210 C   0  0  0  0  0
    3.0588   -0.8719   -2.9130 C   0  0  0  0  0
    3.8420   -0.8915   -1.7729 N   0  0  0  0  0
    5.0553   -0.2501   -1.5029 C   0  0  0  0  0
    5.6472   -0.4083   -0.2992 C   0  0  0  0  0
    4.9711   -1.2607    0.6781 C   0  0  0  0  0
    3.8008   -1.8740    0.4110 C   0  0  0  0  0
    3.1901   -1.7047   -0.8565 C   0  0  0  0  0
    2.0728   -2.1933   -1.3486 N   0  0  0  0  0
    6.8354    0.2355   -0.0265 N   0  0  0  0  0
    7.6150    0.1573    1.1136 C   0  0  0  0  0
    7.3988   -0.5453    2.0941 O   0  0  0  0  0
    8.8911    0.9856    1.0397 C   0  0  0  0  0
    8.6398    2.3070    0.5698 O   0  0  0  0  0
    9.7407    3.1210    0.4923 C   0  0  0  0  0
    9.5597    4.3119   -0.2142 C   0  0  0  0  0
   10.6311    5.1917   -0.4235 C   0  0  0  0  0
   11.8958    4.8782    0.0715 C   0  0  0  0  0
   12.0560    3.7279    0.8436 C   0  0  0  0  0
   10.9893    2.8509    1.0524 C   0  0  0  0  0
   13.0425    5.5909   -0.1155 O   0  0  0  0  0
   13.0803    6.5067   -1.1963 C   0  0  0  0  0
   12.4855    7.6678   -0.8467 F   0  0  0  0  0
   14.3723    6.7643   -1.4956 F   0  0  0  0  0
   12.4889    6.0155   -2.3058 F   0  0  0  0  0
    3.3981   -0.1006   -4.1307 C   0  0  0  0  0
    0.3274   -2.9517   -3.0960 H   0  0  0  0  0
    1.1284   -2.2352   -4.5015 H   0  0  0  0  0
    0.0849   -1.2346   -3.4673 H   0  0  0  0  0
    5.4705    0.3545   -2.2952 H   0  0  0  0  0
    5.4003   -1.4086    1.6607 H   0  0  0  0  0
    3.3077   -2.4952    1.1483 H   0  0  0  0  0
    7.1914    0.8580   -0.7458 H   0  0  0  0  0
    9.5800    0.4673    0.3588 H   0  0  0  0  0
    9.3033    1.0115    2.0539 H   0  0  0  0  0
    8.5813    4.5546   -0.6229 H   0  0  0  0  0
   10.4421    6.1022   -0.9852 H   0  0  0  0  0
   13.0286    3.4931    1.2723 H   0  0  0  0  0
   11.1809    1.9685    1.6524 H   0  0  0  0  0
    2.6043   -0.1723   -4.8798 H   0  0  0  0  0
    4.3212   -0.4795   -4.5810 H   0  0  0  0  0
    3.5347    0.9591   -3.8925 H   0  0  0  0  0
  1  2  1  0  0  0
  1 28  1  0  0  0
  1 29  1  0  0  0
  1 30  1  0  0  0
  2 10  1  0  0  0
  2  3  2  0  0  0
  3  4  1  0  0  0
  3 27  1  0  0  0
  4  9  1  0  0  0
  4  5  1  0  0  0
  5  6  2  0  0  0
  5 31  1  0  0  0
  6  7  1  0  0  0
  6 11  1  0  0  0
  7  8  2  0  0  0
  7 32  1  0  0  0
  8  9  1  0  0  0
  8 33  1  0  0  0
  9 10  2  0  0  0
 11 12  1  0  0  0
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 12 14  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL3771335

>  <PubChem CID>
127029623

>  <Formula>
C18H16F3N3O3

>  <Molecular Weight>
379.339000

>  <IUPAC Name>
N-(2,3-dimethylimidazo[1,2-a]pyridin-6-yl)-2-[4-(trifluoromethoxy)phenoxy]acetamide

>  <XlogP>
4.6

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
7

>  <Canonical SMILES>
CC1=C(N2C=C(C=CC2=N1)NC(=O)COC3=CC=C(C=C3)OC(F)(F)F)C

>  <Isomeric SMILES>
CC1=C(N2C=C(C=CC2=N1)NC(=O)COC3=CC=C(C=C3)OC(F)(F)F)C

>  <InChI Std. ID>
InChI=1S/C18H16F3N3O3/c1-11-12(2)24-9-13(3-8-16(24)22-11)23-17(25)10-26-14-4-6-15(7-5-14)27-18(19,20)21/h3-9H,10H2,1-2H3,(H,23,25)

>  <InChI Key>
DIZOQNXEOQHGSR-UHFFFAOYSA-N

