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3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
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![3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1ec17e0f27b74888b0a119526efafdb6.png "3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one")
3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
structure -
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CAS No:
59898-70-3
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Formula:
C18H18N2OS2
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Chemical Name:
3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
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Synonyms:
3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one;ChemDiv3_001801;Oprea1_282524;Oprea1_512270;Oprea1_835098;HMS1478B19;ZINC1248416;STK438771;STK995772;AKOS001087102
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CAS No:
3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one Basic Attributes
342.47832
342.086
Computed Properties
Molecular Weight:342.5
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:342.08605555
Monoisotopic Mass:342.08605555
Topological Polar Surface Area:92.7
Heavy Atom Count:23
Complexity:478
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 3-benzyl-2-thioxo-1,2,3,5,6,7,8,9-octahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
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