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(4E)-4-[(4-bromophenyl)methylidene]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepin-5-one
(4E)-4-[(4-bromophenyl)methylidene]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepin-5-one
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![(4E)-4-[(4-bromophenyl)methylidene]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepin-5-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e39c7ddddb734f6abc88cbecba06fa22.png "(4E)-4-[(4-bromophenyl)methylidene]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepin-5-one")
(4E)-4-[(4-bromophenyl)methylidene]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepin-5-one
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CAS No:
81326-73-0
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Formula:
C17H13BrO3S
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Chemical Name:
(4E)-4-[(4-bromophenyl)methylidene]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepin-5-one
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Synonyms:
ZINC2274835;STL326709;AKOS022137809;(4E)-4-(4-bromobenzylidene)-3,4-dihydro-1-benzothiepin-5(2H)-one 1,1-dioxide;81326-73-0
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CAS No:
(4E)-4-[(4-bromophenyl)methylidene]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepin-5-one Basic Attributes
377.3 g/mol
375.97688 g/mol
Computed Properties
Molecular Weight:377.3
XLogP3:3.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:375.97688
Monoisotopic Mass:375.97688
Topological Polar Surface Area:59.6
Heavy Atom Count:22
Complexity:553
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of (4E)-4-[(4-bromophenyl)methylidene]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepin-5-one
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