(6Z)-6-[[4-[3-(2,5-dimethylphenoxy)propoxy]phenyl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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![(6Z)-6-[[4-[3-(2,5-dimethylphenoxy)propoxy]phenyl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a53bbcc58add4079a7a34a265a20014c.png "(6Z)-6-[[4-[3-(2,5-dimethylphenoxy)propoxy]phenyl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
(6Z)-6-[[4-[3-(2,5-dimethylphenoxy)propoxy]phenyl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
structure -
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CAS No:
840516-25-8
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Formula:
C28H25N5O3S
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Chemical Name:
(6Z)-6-[[4-[3-(2,5-dimethylphenoxy)propoxy]phenyl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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Synonyms:
ZINC2359072;STK555333;AKOS005481625;(6Z)-6-{4-[3-(2,5-dimethylphenoxy)propoxy]benzylidene}-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one;840516-25-8
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CAS No:
(6Z)-6-[[4-[3-(2,5-dimethylphenoxy)propoxy]phenyl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Basic Attributes
511.6 g/mol
511.16781085 g/mol
Computed Properties
Molecular Weight:511.6
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:511.16781085
Monoisotopic Mass:511.16781085
Topological Polar Surface Area:126
Heavy Atom Count:37
Complexity:942
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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