5-[(E)-3-(6-bromo-4-oxochromen-3-yl)prop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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![5-[(E)-3-(6-bromo-4-oxochromen-3-yl)prop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/dd8f96aa606347a9a0e1f553d980d763.png "5-[(E)-3-(6-bromo-4-oxochromen-3-yl)prop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione")
5-[(E)-3-(6-bromo-4-oxochromen-3-yl)prop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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CAS No:
799791-46-1
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Formula:
C16H9BrN2O4S
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Chemical Name:
5-[(E)-3-(6-bromo-4-oxochromen-3-yl)prop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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Synonyms:
C16H9BrN2O4S;ZINC2215789;STL337486;AKOS022137960;(E)-5-(3-(6-bromo-4-oxo-4H-chromen-3-yl)allylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;5-[(2E)-3-(6-bromo-4-oxo-4H-chromen-3-yl)prop-2-en-1-ylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;799791-46-1
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CAS No:
5-[(E)-3-(6-bromo-4-oxochromen-3-yl)prop-2-enylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Basic Attributes
405.2 g/mol
403.94664 g/mol
Computed Properties
Molecular Weight:405.2
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:403.94664
Monoisotopic Mass:403.94664
Topological Polar Surface Area:117
Heavy Atom Count:24
Complexity:691
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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