(6E)-6-[[5-(4-bromophenyl)furan-2-yl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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![(6E)-6-[[5-(4-bromophenyl)furan-2-yl]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/20220811/05cdcef4cc274b069b8469100aa0f8bd.png "(6E)-6-[[5-(4-bromophenyl)furan-2-yl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
(6E)-6-[[5-(4-bromophenyl)furan-2-yl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
structure -
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CAS No:
846596-84-7
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Formula:
C21H12BrN5O2S
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Chemical Name:
(6E)-6-[[5-(4-bromophenyl)furan-2-yl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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Synonyms:
C21H12BrN5O2S;STL234315;ZINC13770826;AKOS025274223;(6E)-6-{[5-(4-bromophenyl)furan-2-yl]methylidene}-5-imino-2-(pyridin-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one;846596-84-7
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CAS No:
(6E)-6-[[5-(4-bromophenyl)furan-2-yl]methylidene]-5-imino-2-pyridin-3-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Basic Attributes
478.3 g/mol
476.98951 g/mol
Computed Properties
Molecular Weight:478.3
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:476.98951
Monoisotopic Mass:476.98951
Topological Polar Surface Area:120
Heavy Atom Count:30
Complexity:820
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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