
 2-[4-(2-Methyl-1H-imidazo[4,5-c]pyridin-1-yl)phenyl]-4-(2-pyridinyl)-5-(2-pyridinylcarbamoyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester

 72 77  0  0  0  0  0  0  0  0999 V2000
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    2.7601    0.0874   -0.8656 C   0  0  0  0  0
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    0.2550    4.3149    1.6150 C   0  0  0  0  0
    0.2489    3.4602    2.7246 C   0  0  0  0  0
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    2.5922    2.9702    2.2950 C   0  0  0  0  0
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   -2.3307    3.1124    5.2534 N   0  0  0  0  0
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    1.6732    0.1350   -0.9915 H   0  0  0  0  0
    3.5624    6.0843    0.6675 H   0  0  0  0  0
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    5.6204    7.7920    0.3905 H   0  0  0  0  0
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M  END

>  <Chemical Name>
2-[4-(2-Methyl-1H-imidazo[4,5-c]pyridin-1-yl)phenyl]-4-(2-pyridinyl)-5-(2-pyridinylcarbamoyl)-6-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester

>  <PubChem CID>
15005376

>  <Formula>
C33H29N7O3

>  <Molecular Weight>
571.641000

>  <IUPAC Name>
ethyl 6-methyl-2-[4-(2-methylimidazo[4,5-c]pyridin-1-yl)phenyl]-4-pyridin-2-yl-5-(pyridin-2-ylcarbamoyl)-1,4-dihydropyridine-3-carboxylate

>  <XlogP>
3.9

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
8

>  <Canonical SMILES>
CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=N2)C(=O)NC3=CC=CC=N3)C)C4=CC=C(C=C4)N5C(=NC6=C5C=CN=C6)C

>  <Isomeric SMILES>
CCOC(=O)C1=C(NC(=C(C1C2=CC=CC=N2)C(=O)NC3=CC=CC=N3)C)C4=CC=C(C=C4)N5C(=NC6=C5C=CN=C6)C

>  <InChI Std. ID>
InChI=1S/C33H29N7O3/c1-4-43-33(42)30-29(24-9-5-7-16-35-24)28(32(41)39-27-10-6-8-17-36-27)20(2)37-31(30)22-11-13-23(14-12-22)40-21(3)38-25-19-34-18-15-26(25)40/h5-19,29,37H,4H2,1-3H3,(H,36,39,41)

>  <InChI Key>
JAYWFCIZDUPPOC-UHFFFAOYSA-N

