7-ethyl-6-imino-13-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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![7-ethyl-6-imino-13-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/20220812/73483ae013414525b69b057dc7ba3771.png "7-ethyl-6-imino-13-methyl-5-(4-methylphenyl)sulfonyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one")
7-ethyl-6-imino-13-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:
606955-99-1
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Formula:
C21H20N4O3S
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Chemical Name:
7-ethyl-6-imino-13-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:
606955-99-1;1-ethyl-2-imino-8-methyl-3-tosyl-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one;STK552599;AKOS001471073;ZINC100846633;MCULE-9855804373;ST50073743;F3226-0209;1-ethyl-2-imino-8-methyl-3-[(4-methylphenyl)sulfonyl]-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one;1-ethyl-2-imino-8-methyl-3-[(4-methylphenyl)sulfonyl]-1,6-dihydropyridino[1,2- a]pyridino[2,3-d]pyrimidin-5-one;7-ethyl-6-imino-13-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:
7-ethyl-6-imino-13-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
408.5 g/mol
408.12561169 g/mol
Computed Properties
Molecular Weight:408.5
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:408.12561169
Monoisotopic Mass:408.12561169
Topological Polar Surface Area:102
Heavy Atom Count:29
Complexity:1030
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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