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1-(3,4-dimethylphenyl)-5-(furan-2-ylmethyliminomethyl)-6-hydroxy-2-sulfanylidenepyrimidin-4-one

1-(3,4-dimethylphenyl)-5-(furan-2-ylmethyliminomethyl)-6-hydroxy-2-sulfanylidenepyrimidin-4-one structure

CAS No:
680218-83-1
Formula:
C18H17N3O3S
Chemical Name:
1-(3,4-dimethylphenyl)-5-(furan-2-ylmethyliminomethyl)-6-hydroxy-2-sulfanylidenepyrimidin-4-one
Synonyms:
MLS000559840;CHEMBL1498097;HMS2808P09;ZINC5691063;STL057000;AKOS005709647;AKOS032383756;ZINC101037699;MCULE-4318876059;SMR000438323;(5E)-1-(3,4-dimethylphenyl)-5-{[(furan-2-ylmethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione;1-(3,4-Dimethyl-phenyl)-5-[1-[(furan-2-ylmethyl)-amino]-meth-(Z)-ylidene]-2-thioxo-dihydro-pyrimidine-4, 6-dione;680218-83-1

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1-(3,4-dimethylphenyl)-5-(furan-2-ylmethyliminomethyl)-6-hydroxy-2-sulfanylidenepyrimidin-4-one Basic Attributes

Molecular Weight：

355.4 g/mol

Exact Mass：

355.09906259 g/mol

Characteristics

PSA：

110 Å²

Water Solubility：

11.1 [ug/mL]

Computed Properties

Molecular Weight:355.4
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:355.09906259
Monoisotopic Mass:355.09906259
Topological Polar Surface Area:110
Heavy Atom Count:25
Complexity:604
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(3,4-dimethylphenyl)-5-(furan-2-ylmethyliminomethyl)-6-hydroxy-2-sulfanylidenepyrimidin-4-one

Basic Attributes
Characteristics
Computed Properties

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