AC1M3IJ3
(5E)-1-(3-chloro-2-methylphenyl)-5-[(2,5-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: (5E)-1-(3-chloro-2-methylphenyl)-5-(2,5-dimethoxybenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|(5E)-1-(3-chloro-2-methylphenyl)-5-[(2,5-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
CAS: 593271-42-2
| Molecular Formula | C20H17ClN2O4S |
|---|---|
| Molecular Weight | 416.05975 g/mol |
| LogP | 3.49692 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.05975 |
| Monoisotopic Mass | 416.05975 |
| Heavy Atoms | 28 |
| Complexity | 1019.26044 |
Chemical Identifiers
| CAS Number | 593271-42-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)N2C(=O)/C(=C/C3=C(C=CC(=C3)OC)OC)/C(=O)NC2=S |
Product Overview
AC1M3IJ3 (CAS 593271-42-2), with molecular formula C20H17ClN2O4S and molecular weight 416.05975 g/mol. IUPAC: (5E)-1-(3-chloro-2-methylphenyl)-5-[(2,5-dimethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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