AC1LEHSY
5-[(2,4-diethoxyphenyl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: alpha-hydroxycaproic acid|4,6(1h,5h)-pyrimidinedione, 5-[(2,4-diethoxyphenyl)methylene]dihydro-1,3-dimethyl-2-thioxo-|5-[(2,4-diethoxyphenyl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione|5-(2,4-diethoxybenzylidene)-1,3-dimethyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione|5-(2,4-diethoxybenzylidene)-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C17H20N2O4S |
|---|---|
| Molecular Weight | 348.11438 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 91.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.11438 |
| Monoisotopic Mass | 348.11438 |
| Heavy Atoms | 24 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 6340-33-6 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)C=C2C(=O)N(C(=S)N(C2=O)C)C)OCC |
| InChIKey | WQATYLDOFDXNSB-UHFFFAOYSA-N |
Product Overview
AC1LEHSY (CAS 6340-33-6), with molecular formula C17H20N2O4S and molecular weight 348.11438 g/mol. IUPAC: 5-[(2,4-diethoxyphenyl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
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