
 CHEMBL1771448

 71 75  0  0  0  0  0  0  0  0999 V2000
    5.3808    2.9694    1.9994 C   0  0  0  0  0
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M  END

>  <Chemical Name>
CHEMBL1771448

>  <PubChem CID>
54585478

>  <Formula>
C32H34N4O

>  <Molecular Weight>
490.651000

>  <IUPAC Name>
N-(3-ethylphenyl)-4-(2-methylphenyl)-2-(4-propan-2-ylphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide

>  <XlogP>
6.6

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CCC1=CC(=CC=C1)NC(=O)N2CCC3=NC(=NC(=C3C2)C4=CC=CC=C4C)C5=CC=C(C=C5)C(C)C

>  <Isomeric SMILES>
CCC1=CC(=CC=C1)NC(=O)N2CCC3=NC(=NC(=C3C2)C4=CC=CC=C4C)C5=CC=C(C=C5)C(C)C

>  <InChI Std. ID>
InChI=1S/C32H34N4O/c1-5-23-10-8-11-26(19-23)33-32(37)36-18-17-29-28(20-36)30(27-12-7-6-9-22(27)4)35-31(34-29)25-15-13-24(14-16-25)21(2)3/h6-16,19,21H,5,17-18,20H2,1-4H3,(H,33,37)

>  <InChI Key>
ZHZSUEYGBKFGMM-UHFFFAOYSA-N

