
 SCHEMBL2193917

 32 35  0  0  0  0  0  0  0  0999 V2000
   -1.3301    0.7864    0.7714 C   0  0  0  0  0
   -0.8419   -0.2469   -0.1850 C   0  0  0  0  0
    0.1535    0.6800    0.4833 C   0  0  0  0  0
    1.0511    0.1065    1.5875 C   0  0  0  0  0
    0.6969   -0.9810    2.2537 N   0  0  0  0  0
    1.7664   -1.2702    3.0187 C   0  0  0  0  0
    2.7741   -0.3567    2.8853 C   0  0  0  0  0
    2.3188    0.5711    1.9641 N   0  0  0  0  0
    2.9382    1.7989    1.5935 C   0  0  0  0  0
    2.1265    2.9447    1.5040 C   0  0  0  0  0
    2.6789    4.1848    1.1755 C   0  0  0  0  0
    4.0453    4.2996    0.9455 C   0  0  0  0  0
    4.8594    3.1718    1.0328 C   0  0  0  0  0
    4.3147    1.9195    1.3494 C   0  0  0  0  0
    5.4071    0.5825    1.2790 Cl  0  0  0  0  0
    3.9189   -0.4438    3.6567 N   0  0  0  0  0
    4.0912   -1.5341    4.5701 C   0  0  0  0  0
    5.1189   -1.5940    5.2168 O   0  0  0  0  0
    2.9759   -2.5132    4.6532 C   0  0  0  0  0
    1.8726   -2.3630    3.9039 C   0  0  0  0  0
   -1.8649    1.6393    0.3694 H   0  0  0  0  0
   -1.7014    0.4495    1.7337 H   0  0  0  0  0
   -1.0454   -0.1008   -1.2396 H   0  0  0  0  0
   -0.8889   -1.2848    0.1285 H   0  0  0  0  0
    0.5849    1.4551   -0.1403 H   0  0  0  0  0
    1.0602    2.9137    1.7233 H   0  0  0  0  0
    2.0417    5.0651    1.1076 H   0  0  0  0  0
    4.4759    5.2656    0.6889 H   0  0  0  0  0
    5.9240    3.2762    0.8282 H   0  0  0  0  0
    4.6762    0.2216    3.5671 H   0  0  0  0  0
    3.1070   -3.3379    5.3428 H   0  0  0  0  0
    1.0522   -3.0732    3.9617 H   0  0  0  0  0
  1  3  1  0  0  0
  1  2  1  0  0  0
  1 21  1  0  0  0
  1 22  1  0  0  0
  2  3  1  0  0  0
  2 23  1  0  0  0
  2 24  1  0  0  0
  3  4  1  0  0  0
  3 25  1  0  0  0
  4  5  2  0  0  0
  4  8  1  0  0  0
  5  6  1  0  0  0
  6 20  1  0  0  0
  6  7  2  0  0  0
  7  8  1  0  0  0
  7 16  1  0  0  0
  8  9  1  0  0  0
  9 10  2  0  0  0
  9 14  1  0  0  0
 10 11  1  0  0  0
 10 26  1  0  0  0
 11 12  2  0  0  0
 11 27  1  0  0  0
 12 13  1  0  0  0
 12 28  1  0  0  0
 13 14  2  0  0  0
 13 29  1  0  0  0
 14 15  1  0  0  0
 16 17  1  0  0  0
 16 30  1  0  0  0
 17 19  1  0  0  0
 17 18  2  0  0  0
 19 20  2  0  0  0
 19 31  1  0  0  0
 20 32  1  0  0  0
M  END

>  <Chemical Name>
SCHEMBL2193917

>  <PubChem CID>
58345768

>  <Formula>
C15H12ClN3O

>  <Molecular Weight>
285.731000

>  <IUPAC Name>
3-(2-chlorophenyl)-2-cyclopropyl-4H-imidazo[4,5-b]pyridin-5-one

>  <XlogP>
2.7

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1CC1C2=NC3=C(N2C4=CC=CC=C4Cl)NC(=O)C=C3

>  <Isomeric SMILES>
C1CC1C2=NC3=C(N2C4=CC=CC=C4Cl)NC(=O)C=C3

>  <InChI Std. ID>
InChI=1S/C15H12ClN3O/c16-10-3-1-2-4-12(10)19-14(9-5-6-9)17-11-7-8-13(20)18-15(11)19/h1-4,7-9H,5-6H2,(H,18,20)

>  <InChI Key>
AXGGHPMVSGFWGC-UHFFFAOYSA-N

