1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(3-hydroxypropyliminomethyl)-2-sulfanylidenepyrimidin-4-one
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1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(3-hydroxypropyliminomethyl)-2-sulfanylidenepyrimidin-4-one
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CAS No:
578700-28-4
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Formula:
C16H23N3O3S
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Chemical Name:
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(3-hydroxypropyliminomethyl)-2-sulfanylidenepyrimidin-4-one
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Synonyms:
ZINC5829785;STK565677;AKOS005490919;AKOS032386179;MCULE-8509101963;(5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-{[(3-hydroxypropyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione;(E)-1-(2-(cyclohex-1-en-1-yl)ethyl)-5-(((3-hydroxypropyl)amino)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;578700-28-4
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CAS No:
1-[2-(cyclohexen-1-yl)ethyl]-6-hydroxy-5-(3-hydroxypropyliminomethyl)-2-sulfanylidenepyrimidin-4-one Basic Attributes
337.4 g/mol
337.14601278 g/mol
Computed Properties
Molecular Weight:337.4
XLogP3:1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:337.14601278
Monoisotopic Mass:337.14601278
Topological Polar Surface Area:117
Heavy Atom Count:23
Complexity:555
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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