1-(3,5-dimethylphenyl)-6-hydroxy-5-(2-phenylethyliminomethyl)-2-sulfanylidenepyrimidin-4-one
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1-(3,5-dimethylphenyl)-6-hydroxy-5-(2-phenylethyliminomethyl)-2-sulfanylidenepyrimidin-4-one
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CAS No:
714286-16-5
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Formula:
C21H21N3O2S
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Chemical Name:
1-(3,5-dimethylphenyl)-6-hydroxy-5-(2-phenylethyliminomethyl)-2-sulfanylidenepyrimidin-4-one
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Synonyms:
ZINC5886060;STL006645;STL056586;AKOS005709081;AKOS032390960;ZINC101184202;MCULE-5449076281;(5E)-1-(3,5-dimethylphenyl)-5-{[(2-phenylethyl)amino]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;(5Z)-1-(3,5-dimethylphenyl)-5-{[(2-phenylethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione;714286-16-5
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CAS No:
1-(3,5-dimethylphenyl)-6-hydroxy-5-(2-phenylethyliminomethyl)-2-sulfanylidenepyrimidin-4-one Basic Attributes
379.5 g/mol
379.13544809 g/mol
Computed Properties
Molecular Weight:379.5
XLogP3:3.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:379.13544809
Monoisotopic Mass:379.13544809
Topological Polar Surface Area:97
Heavy Atom Count:27
Complexity:615
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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