4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-3-hydroxy-2-(6-methylpyridin-2-yl)isoquinolin-1-one
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![4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-3-hydroxy-2-(6-methylpyridin-2-yl)isoquinolin-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/ab074690dc7e4b2f850f33c35ff32c8c.png "4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-3-hydroxy-2-(6-methylpyridin-2-yl)isoquinolin-1-one")
4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-3-hydroxy-2-(6-methylpyridin-2-yl)isoquinolin-1-one
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CAS No:
554404-85-2
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Formula:
C23H17F2N3O2S
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Chemical Name:
4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-3-hydroxy-2-(6-methylpyridin-2-yl)isoquinolin-1-one
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Synonyms:
STK590621;ZINC12648072;AKOS001063863;AKOS005513206;AKOS030661429;ZINC102607356;MCULE-1900198549;(4E)-4-[({4-[(difluoromethyl)sulfanyl]phenyl}amino)methylidene]-2-(6-methylpyridin-2-yl)isoquinoline-1,3(2H,4H)-dione;554404-85-2
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CAS No:
4-[[4-(difluoromethylsulfanyl)phenyl]iminomethyl]-3-hydroxy-2-(6-methylpyridin-2-yl)isoquinolin-1-one Basic Attributes
437.5 g/mol
437.10095429 g/mol
Computed Properties
Molecular Weight:437.5
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:437.10095429
Monoisotopic Mass:437.10095429
Topological Polar Surface Area:91.1
Heavy Atom Count:31
Complexity:709
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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