(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
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(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
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CAS No:
846590-92-9
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Formula:
C18H21N3O2S
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Chemical Name:
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
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Synonyms:
MLS000333198;CHEMBL1311010;HMS2790H04;ZINC5215675;STL004631;AKOS032388614;SMR000436538;(5Z)-5-[4-(azepan-1-yl)benzylidene]-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;5-[1-(4-Azepan-1-yl-phenyl)-meth-(Z)-ylidene]-1-methyl-2-thioxo-dihydro-pyrimidine-4,6-dione;846590-92-9
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CAS No:
(5Z)-5-[[4-(azepan-1-yl)phenyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Basic Attributes
343.4 g/mol
343.13544809 g/mol
Computed Properties
Molecular Weight:343.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:343.13544809
Monoisotopic Mass:343.13544809
Topological Polar Surface Area:84.7
Heavy Atom Count:24
Complexity:545
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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