4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-2-(2,4-dimethylphenyl)-3-hydroxyisoquinolin-1-one
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![4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-2-(2,4-dimethylphenyl)-3-hydroxyisoquinolin-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/25d0a5ebb6f4434cb75911bec731feb8.png "4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-2-(2,4-dimethylphenyl)-3-hydroxyisoquinolin-1-one")
4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-2-(2,4-dimethylphenyl)-3-hydroxyisoquinolin-1-one
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CAS No:
568552-37-4
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Formula:
C25H20F2N2O2S
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Chemical Name:
4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-2-(2,4-dimethylphenyl)-3-hydroxyisoquinolin-1-one
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Synonyms:
C25H20F2N2O2S;ZINC9236552;STK579489;AKOS001042673;AKOS030743260;ZINC102586603;MCULE-9857062724;(4Z)-4-[({4-[(difluoromethyl)sulfanyl]phenyl}amino)methylidene]-2-(2,4-dimethylphenyl)isoquinoline-1,3(2H,4H)-dione;568552-37-4
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CAS No:
4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-2-(2,4-dimethylphenyl)-3-hydroxyisoquinolin-1-one Basic Attributes
450.5 g/mol
450.12135538 g/mol
Computed Properties
Molecular Weight:450.5
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:450.12135538
Monoisotopic Mass:450.12135538
Topological Polar Surface Area:78.2
Heavy Atom Count:32
Complexity:736
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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