2-(3,4-dimethylphenyl)-6-methyl-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraene-10,12-dione
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![2-(3,4-dimethylphenyl)-6-methyl-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraene-10,12-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/fc8f02cebd61497ca07a9cb8764152c8.png "2-(3,4-dimethylphenyl)-6-methyl-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraene-10,12-dione")
2-(3,4-dimethylphenyl)-6-methyl-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraene-10,12-dione
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CAS No:
799799-01-2
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Formula:
C23H19N5O2
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Chemical Name:
2-(3,4-dimethylphenyl)-6-methyl-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraene-10,12-dione
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Synonyms:
CHEMBL1356423;HMS1823A06;ZINC2221842;STK654276;AKOS001806969;AKOS005584814;MCULE-9613120205;NCGC00108017-01;C362-0242;799799-01-2;9-(3,4-dimethylphenyl)-3-methyl-1-phenyl-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidine-5,7(6H,9H)-dione;9-(3,4-dimethylphenyl)-7-hydroxy-3-methyl-1-phenyl-1,9-dihydro-5H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidin-5-one
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CAS No:
2-(3,4-dimethylphenyl)-6-methyl-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraene-10,12-dione Basic Attributes
397.4 g/mol
397.15387487 g/mol
Computed Properties
Molecular Weight:397.4
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:397.15387487
Monoisotopic Mass:397.15387487
Topological Polar Surface Area:79.6
Heavy Atom Count:30
Complexity:787
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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