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(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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![(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0b0131a694e2400e9f6abc8b9c3214f0.png "(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione")
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
structure -
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CAS No:
848929-03-3
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Formula:
C25H27N3O3S
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Chemical Name:
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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Synonyms:
ZINC9232786;STK597872;AKOS005519079;(5Z)-5-[4-(azepan-1-yl)benzylidene]-1-(4-ethoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;848929-03-3
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CAS No:
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Basic Attributes
449.6 g/mol
449.17731291 g/mol
Computed Properties
Molecular Weight:449.6
XLogP3:5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:449.17731291
Monoisotopic Mass:449.17731291
Topological Polar Surface Area:94
Heavy Atom Count:32
Complexity:716
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-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
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