1-(3,5-dimethylphenyl)-6-hydroxy-5-[(4-methoxyphenyl)methyliminomethyl]-2-sulfanylidenepyrimidin-4-one
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1-(3,5-dimethylphenyl)-6-hydroxy-5-[(4-methoxyphenyl)methyliminomethyl]-2-sulfanylidenepyrimidin-4-one
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CAS No:
714921-66-1
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Formula:
C21H21N3O3S
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Chemical Name:
1-(3,5-dimethylphenyl)-6-hydroxy-5-[(4-methoxyphenyl)methyliminomethyl]-2-sulfanylidenepyrimidin-4-one
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Synonyms:
ZINC5886064;STK567835;STL006971;AKOS005493720;AKOS032391925;MCULE-4138734392;(5Z)-1-(3,5-dimethylphenyl)-5-{[(4-methoxybenzyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione;(5Z)-1-(3,5-dimethylphenyl)-5-{[(4-methoxybenzyl)amino]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;714921-66-1
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CAS No:
1-(3,5-dimethylphenyl)-6-hydroxy-5-[(4-methoxyphenyl)methyliminomethyl]-2-sulfanylidenepyrimidin-4-one Basic Attributes
395.5 g/mol
395.13036271 g/mol
Computed Properties
Molecular Weight:395.5
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:395.13036271
Monoisotopic Mass:395.13036271
Topological Polar Surface Area:106
Heavy Atom Count:28
Complexity:645
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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