Hydroxyphenobarbital
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Hydroxyphenobarbital
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CAS No:
379-34-0
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Formula:
C12H12N2O4
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Chemical Name:
Hydroxyphenobarbital
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Synonyms:
2,4,6(1H,3H,5H)-Pyrimidinetrione,5-ethyl-5-(4-hydroxyphenyl)-;Barbituric acid,5-ethyl-5-(p-hydroxyphenyl)-;5-Ethyl-5-(4-hydroxyphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione;p-Hydroxyphenobarbital;Hydroxyphenobarbital;p-Hydroxyphenobarbitone;5-Ethyl-5-(4-hydroxyphenyl)barbituric acid;4-Hydroxyphenobarbital;5-(p-Hydroxyphenyl)-5-ethylbarbituric acid;5-Ethyl-5-(p-hydroxyphenyl)barbituric acid;NSC 159266
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CAS No:
Hydroxyphenobarbital Basic Attributes
248.238
248.23
206-831-7
RF9R6T1NUN
159266
DTXSID20191328
2933540000
Drug Information
P-Hydroxyphenobarbital has known human metabolites that include (2S,3S,4S,5R)-6-[4-(5-ethyl-2,4,6-trioxo-1,3-diazinan-5-yl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid and 4-(5-Ethyl-2,4,6-trioxohexahydropyrimidin-5-yl)phenyl hydrogen sulfate.
4-hydroxyphenobarbital
Computed Properties
Molecular Weight:248.23
XLogP3:1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:248.07970687
Monoisotopic Mass:248.07970687
Topological Polar Surface Area:95.5
Heavy Atom Count:18
Complexity:366
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes