6-imino-7-[(4-methoxyphenyl)methyl]-11-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-7-[(4-methoxyphenyl)methyl]-11-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/20220811/9ecf1d4c16c34b43aa1c461c1bb3f858.png "6-imino-7-[(4-methoxyphenyl)methyl]-11-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-7-[(4-methoxyphenyl)methyl]-11-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:
371137-81-4
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Formula:
C27H24N4O4S
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Chemical Name:
6-imino-7-[(4-methoxyphenyl)methyl]-11-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:
STK553065;AKOS002179185;ZINC100863317;MCULE-1655541283;ST50068621;2-imino-1-(4-methoxybenzyl)-10-methyl-3-[(4-methylphenyl)sulfonyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one;2-imino-1-[(4-methoxyphenyl)methyl]-10-methyl-3-[(4-methylphenyl)sulfonyl]-1,6 -dihydropyridino[2,3-d]pyridino[1,2-a]pyrimidin-5-one;371137-81-4
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CAS No:
6-imino-7-[(4-methoxyphenyl)methyl]-11-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
500.6 g/mol
500.15182643 g/mol
Computed Properties
Molecular Weight:500.6
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:500.15182643
Monoisotopic Mass:500.15182643
Topological Polar Surface Area:112
Heavy Atom Count:36
Complexity:1200
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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