(6E)-5-imino-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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![(6E)-5-imino-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/dd886ac70a3d40dea0da799c667c7d8e.png "(6E)-5-imino-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
(6E)-5-imino-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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CAS No:
847244-22-8
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Formula:
C27H20N6OS
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Chemical Name:
(6E)-5-imino-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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Synonyms:
ZINC9282692;STL232455;AKOS025272754;(6E)-5-imino-6-{[1-(3-methylbenzyl)-1H-indol-3-yl]methylidene}-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one;(E)-5-imino-6-((1-(3-methylbenzyl)-1H-indol-3-yl)methylene)-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one;847244-22-8
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CAS No:
(6E)-5-imino-6-[[1-[(3-methylphenyl)methyl]indol-3-yl]methylidene]-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Basic Attributes
476.6 g/mol
476.14193046 g/mol
Computed Properties
Molecular Weight:476.6
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:476.14193046
Monoisotopic Mass:476.14193046
Topological Polar Surface Area:112
Heavy Atom Count:35
Complexity:959
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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