(6Z)-2-(1,3-benzodioxol-5-yl)-5-imino-6-[(4-methylphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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![(6Z)-2-(1,3-benzodioxol-5-yl)-5-imino-6-[(4-methylphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/7d041ecef73f4101b597f086e1342b34.png "(6Z)-2-(1,3-benzodioxol-5-yl)-5-imino-6-[(4-methylphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one")
(6Z)-2-(1,3-benzodioxol-5-yl)-5-imino-6-[(4-methylphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
structure -
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CAS No:
850160-55-3
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Formula:
C20H14N4O3S
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Chemical Name:
(6Z)-2-(1,3-benzodioxol-5-yl)-5-imino-6-[(4-methylphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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Synonyms:
ZINC13806428;AKOS032392666;(Z)-2-(benzo[d][1,3]dioxol-5-yl)-5-imino-6-(4-methylbenzylidene)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one;850160-55-3
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CAS No:
(6Z)-2-(1,3-benzodioxol-5-yl)-5-imino-6-[(4-methylphenyl)methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Basic Attributes
390.4 g/mol
390.07866149 g/mol
Computed Properties
Molecular Weight:390.4
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:390.07866149
Monoisotopic Mass:390.07866149
Topological Polar Surface Area:113
Heavy Atom Count:28
Complexity:784
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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