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(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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![(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0f4742f821f7429db567b2b3196dfc8c.png "(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione")
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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CAS No:
673444-24-1
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Formula:
C23H22FN3O2S
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Chemical Name:
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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Synonyms:
ZINC9161402;STL005637;AKOS032389659;(5Z)-5-[4-(azepan-1-yl)benzylidene]-1-(2-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;673444-24-1
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CAS No:
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Basic Attributes
423.5 g/mol
423.14167629 g/mol
Computed Properties
Molecular Weight:423.5
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:423.14167629
Monoisotopic Mass:423.14167629
Topological Polar Surface Area:84.7
Heavy Atom Count:30
Complexity:697
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of (5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-fluorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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