(6Z)-2-benzylsulfanyl-6-[[4-(dimethylamino)phenyl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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![(6Z)-2-benzylsulfanyl-6-[[4-(dimethylamino)phenyl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3e4e0d2ef95f417a8f5653cc4a318882.png "(6Z)-2-benzylsulfanyl-6-[[4-(dimethylamino)phenyl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
(6Z)-2-benzylsulfanyl-6-[[4-(dimethylamino)phenyl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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CAS No:
840511-70-8
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Formula:
C21H19N5OS2
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Chemical Name:
(6Z)-2-benzylsulfanyl-6-[[4-(dimethylamino)phenyl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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Synonyms:
STK712469;ZINC13752280;AKOS005523561;(6Z)-2-(benzylsulfanyl)-6-[4-(dimethylamino)benzylidene]-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one;(Z)-2-(benzylthio)-6-(4-(dimethylamino)benzylidene)-5-imino-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one;840511-70-8
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CAS No:
(6Z)-2-benzylsulfanyl-6-[[4-(dimethylamino)phenyl]methylidene]-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Basic Attributes
421.5 g/mol
421.10310259 g/mol
Computed Properties
Molecular Weight:421.5
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:421.10310259
Monoisotopic Mass:421.10310259
Topological Polar Surface Area:123
Heavy Atom Count:29
Complexity:746
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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