5-(benzenesulfonyl)-6-imino-7-[(4-methoxyphenyl)methyl]-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
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![5-(benzenesulfonyl)-6-imino-7-[(4-methoxyphenyl)methyl]-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/20220812/403c2bf6b5304ccaa0d0a83f60794250.png "5-(benzenesulfonyl)-6-imino-7-[(4-methoxyphenyl)methyl]-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one")
5-(benzenesulfonyl)-6-imino-7-[(4-methoxyphenyl)methyl]-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:
636991-03-2
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Formula:
C25H20N4O4S
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Chemical Name:
5-(benzenesulfonyl)-6-imino-7-[(4-methoxyphenyl)methyl]-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one
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Synonyms:
STK554085;AKOS002185099;ZINC100870198;MCULE-4710271878;ST50074052;2-imino-1-(4-methoxybenzyl)-3-(phenylsulfonyl)-1,2-dihydro-5H-dipyrido[1,2-a:2',3'-d]pyrimidin-5-one;2-imino-1-(4-methoxybenzyl)-3-(phenylsulfonyl)-1H-dipyrido[1,2-a:2',3'-d]pyrimidin-5(2H)-one;2-imino-1-[(4-methoxyphenyl)methyl]-3-(phenylsulfonyl)-1,6-dihydropyridino[1,2 -a]pyridino[2,3-d]pyrimidin-5-one;636991-03-2
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CAS No:
5-(benzenesulfonyl)-6-imino-7-[(4-methoxyphenyl)methyl]-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaen-2-one Basic Attributes
472.5 g/mol
472.12052631 g/mol
Computed Properties
Molecular Weight:472.5
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:472.12052631
Monoisotopic Mass:472.12052631
Topological Polar Surface Area:112
Heavy Atom Count:34
Complexity:1130
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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