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5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-butyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one
5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-butyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one
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5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-butyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one
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CAS No:
577986-17-5
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Formula:
C17H19N3O4S
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Chemical Name:
5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-butyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one
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Synonyms:
ZINC5883556;STL038077;AKOS005691843;AKOS032385163;ZINC101063623;MCULE-7495703140;(5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-1-butyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione;577986-17-5
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CAS No:
5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-butyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one Basic Attributes
361.4 g/mol
361.10962727 g/mol
Computed Properties
Molecular Weight:361.4
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:361.10962727
Monoisotopic Mass:361.10962727
Topological Polar Surface Area:116
Heavy Atom Count:25
Complexity:592
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-butyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one
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