ethyl 2-[(3-bromo-4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
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![ethyl 2-[(3-bromo-4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/29e98fb21104470483d423248bcd3154.png "ethyl 2-[(3-bromo-4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate")
ethyl 2-[(3-bromo-4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
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CAS No:
6173-07-5
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Formula:
C21H17BrN2O4S2
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Chemical Name:
ethyl 2-[(3-bromo-4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
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Synonyms:
ethyl (2Z,5S)-2-(3-bromo-4-hydroxybenzylidene)-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate; Methylphosphonsaeurebutylamid-<4-chlorphenylester>CTK5B3643; ETHYL (8Z)-8-[(3-BROMO-4-HYDROXY-PHENYL)METHYLIDENE]-4-METHYL-9-OXO-2-THIOPHEN-2-YL-7-THIA-1,5-DIAZABICYCLO[4.3.0]NONA-3,5-DIENE-3-CARBOXYLATE; Methylphosphonsaeurebutylamid-(4-chlorphenylester);
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CAS No:
ethyl 2-[(3-bromo-4-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Basic Attributes
505.40500
503.98131
DTXSID50387419
Computed Properties
Molecular Weight:505.4
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:503.98131
Monoisotopic Mass:503.98131
Topological Polar Surface Area:133
Heavy Atom Count:30
Complexity:828
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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