5-[[2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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5-[[2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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CAS No:
327085-32-5
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Formula:
C18H14F3N3O2S
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Chemical Name:
5-[[2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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Synonyms:
5-({2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;CHEMBL3632734;ZINC2994594;STK187407;AKOS000329971;MCULE-3301157939;5-[[2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione;SR-01000245735;SR-01000245735-1;327085-32-5
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CAS No:
5-[[2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]pyrrol-3-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Basic Attributes
393.4 g/mol
393.07588236 g/mol
Computed Properties
Molecular Weight:393.4
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:393.07588236
Monoisotopic Mass:393.07588236
Topological Polar Surface Area:95.2
Heavy Atom Count:27
Complexity:657
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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