
 CHEMBL1770321

 46 50  0  0  0  0  0  0  0  0999 V2000
    1.8952    3.2360    2.2746 C   0  0  0  0  0
    3.2158    3.0373    1.8824 C   0  0  0  0  0
    3.5487    1.9591    1.0593 C   0  0  0  0  0
    2.5653    1.0507    0.6228 C   0  0  0  0  0
    1.2345    1.2761    1.0253 C   0  0  0  0  0
    0.9048    2.3575    1.8453 C   0  0  0  0  0
    2.9119   -0.1010   -0.3383 C   0  0  0  0  0
    4.2051   -0.8118    0.0768 C   0  0  0  0  0
    5.3531   -0.4063   -0.0395 O   0  0  0  0  0
    3.8570   -1.9995    0.6172 N   0  0  0  0  0
    2.5526   -2.2370    0.4261 C   0  0  0  0  0
    1.9743   -3.2708    0.7140 O   0  0  0  0  0
    1.9427   -1.1602   -0.1411 O   0  0  0  0  0
    2.9167    0.2962   -1.8035 C   0  0  0  0  0
    2.5662    1.4973   -2.3072 C   0  0  0  0  0
    2.5887    1.7777   -3.7237 C   0  0  0  0  0
    3.0097    0.8488   -4.5971 C   0  0  0  0  0
    3.3981   -0.3763   -4.1083 N   0  0  0  0  0
    3.3654   -0.7420   -2.7864 C   0  0  0  0  0
    3.6908   -1.8720   -2.4369 O   0  0  0  0  0
    3.0419    1.0857   -6.0588 C   0  0  0  0  0
    2.7416    0.0517   -6.9624 C   0  0  0  0  0
    2.7786    0.2528   -8.3552 C   0  0  0  0  0
    2.4981   -0.7888   -9.2550 C   0  0  0  0  0
    2.5351   -0.5717  -10.6335 C   0  0  0  0  0
    2.8456    0.6903  -11.1306 C   0  0  0  0  0
    3.1282    1.7357  -10.2506 C   0  0  0  0  0
    3.1046    1.5295   -8.8616 C   0  0  0  0  0
    3.4020    2.5636   -7.9647 C   0  0  0  0  0
    3.3820    2.3405   -6.5841 C   0  0  0  0  0
    1.6372    4.0789    2.9108 H   0  0  0  0  0
    3.9897    3.7269    2.2116 H   0  0  0  0  0
    4.5892    1.8513    0.7544 H   0  0  0  0  0
    0.4344    0.6158    0.6925 H   0  0  0  0  0
   -0.1287    2.5161    2.1441 H   0  0  0  0  0
    4.5088   -2.7036    0.9149 H   0  0  0  0  0
    2.2326    2.3137   -1.6727 H   0  0  0  0  0
    2.2399    2.7566   -4.0375 H   0  0  0  0  0
    3.7386   -1.0875   -4.7421 H   0  0  0  0  0
    2.4555   -0.9285   -6.5859 H   0  0  0  0  0
    2.2523   -1.7829   -8.8877 H   0  0  0  0  0
    2.3207   -1.3886  -11.3177 H   0  0  0  0  0
    2.8705    0.8619  -12.2036 H   0  0  0  0  0
    3.3699    2.7148  -10.6579 H   0  0  0  0  0
    3.6606    3.5539   -8.3333 H   0  0  0  0  0
    3.6441    3.1670   -5.9273 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1 31  1  0  0  0
  2  3  1  0  0  0
  2 32  1  0  0  0
  3  4  2  0  0  0
  3 33  1  0  0  0
  4  5  1  0  0  0
  4  7  1  0  0  0
  5  6  2  0  0  0
  5 34  1  0  0  0
  6 35  1  0  0  0
  7 13  1  0  0  0
  7  8  1  0  0  0
  7 14  1  0  0  0
  8 10  1  0  0  0
  8  9  2  0  0  0
 10 11  1  0  0  0
 10 36  1  0  0  0
 11 13  1  0  0  0
 11 12  2  0  0  0
 14 15  2  0  0  0
 14 19  1  0  0  0
 15 16  1  0  0  0
 15 37  1  0  0  0
 16 17  2  0  0  0
 16 38  1  0  0  0
 17 18  1  0  0  0
 17 21  1  0  0  0
 18 19  1  0  0  0
 18 39  1  0  0  0
 19 20  2  0  0  0
 21 30  1  0  0  0
 21 22  2  0  0  0
 22 23  1  0  0  0
 22 40  1  0  0  0
 23 28  1  0  0  0
 23 24  2  0  0  0
 24 25  1  0  0  0
 24 41  1  0  0  0
 25 26  2  0  0  0
 25 42  1  0  0  0
 26 27  1  0  0  0
 26 43  1  0  0  0
 27 28  2  0  0  0
 27 44  1  0  0  0
 28 29  1  0  0  0
 29 30  2  0  0  0
 29 45  1  0  0  0
 30 46  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL1770321

>  <PubChem CID>
54583735

>  <Formula>
C24H16N2O4

>  <Molecular Weight>
396.402000

>  <IUPAC Name>
5-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)-5-phenyl-1,3-oxazolidine-2,4-dione

>  <XlogP>
3.9

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1=CC=C(C=C1)C2(C(=O)NC(=O)O2)C3=CC=C(NC3=O)C4=CC5=CC=CC=C5C=C4

>  <Isomeric SMILES>
C1=CC=C(C=C1)C2(C(=O)NC(=O)O2)C3=CC=C(NC3=O)C4=CC5=CC=CC=C5C=C4

>  <InChI Std. ID>
InChI=1S/C24H16N2O4/c27-21-19(24(18-8-2-1-3-9-18)22(28)26-23(29)30-24)12-13-20(25-21)17-11-10-15-6-4-5-7-16(15)14-17/h1-14H,(H,25,27)(H,26,28,29)

>  <InChI Key>
AQBDZPBOUMCEQJ-UHFFFAOYSA-N

