6-imino-11-methyl-7-[(4-methylphenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
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![6-imino-11-methyl-7-[(4-methylphenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5fc63cbbde364b47ba3c4a4a51331092.png "6-imino-11-methyl-7-[(4-methylphenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one")
6-imino-11-methyl-7-[(4-methylphenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
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CAS No:
608104-31-0
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Formula:
C27H24N4O3S
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Chemical Name:
6-imino-11-methyl-7-[(4-methylphenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
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Synonyms:
STK549260;AKOS001455938;ZINC100851443;MCULE-6484394551;ST50068622;2-imino-10-methyl-1-(4-methylbenzyl)-3-[(4-methylphenyl)sulfonyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one;2-imino-10-methyl-1-(4-methylbenzyl)-3-tosyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one;2-imino-10-methyl-1-[(4-methylphenyl)methyl]-3-[(4-methylphenyl)sulfonyl]-1,6- dihydropyridino[2,3-d]pyridino[1,2-a]pyrimidin-5-one;608104-31-0
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CAS No:
6-imino-11-methyl-7-[(4-methylphenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one Basic Attributes
484.6 g/mol
484.15691181 g/mol
Computed Properties
Molecular Weight:484.6
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:484.15691181
Monoisotopic Mass:484.15691181
Topological Polar Surface Area:102
Heavy Atom Count:35
Complexity:1190
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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