hexyl 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate
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hexyl 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate
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CAS No:
497940-20-2
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Formula:
C14H22N2O3S
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Chemical Name:
hexyl 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate
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Synonyms:
ZINC9164804;STK602495;AKOS005538849;AKOS030517939;MCULE-7560316942;hexyl 3-(4-hydroxy-6-methyl-2-sulfanylpyrimidin-5-yl)propanoate;hexyl 3-(6-methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl)propanoate;497940-20-2
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CAS No:
hexyl 3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanoate Basic Attributes
298.40 g/mol
298.13511374 g/mol
Computed Properties
Molecular Weight:298.40
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:298.13511374
Monoisotopic Mass:298.13511374
Topological Polar Surface Area:99.5
Heavy Atom Count:20
Complexity:419
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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