AC1M9IDE
(5E)-5-[(3-bromo-4-propan-2-yloxyphenyl)methylidene]-1-(3,5-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: (5E)-5-[(3-bromo-4-propan-2-yloxyphenyl)methylidene]-1-(3,5-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione|(5E)-5-[3-bromo-4-(propan-2-yloxy)benzylidene]-1-(3,5-dimethylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
CAS: 680982-68-7
| Molecular Formula | C22H21BrN2O3S |
|---|---|
| Molecular Weight | 472.04562 g/mol |
| LogP | 4.68444 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.04562 |
| Monoisotopic Mass | 472.04562 |
| Heavy Atoms | 29 |
| Complexity | 1026.098 |
Chemical Identifiers
| CAS Number | 680982-68-7 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3)OC(C)C)Br)/C(=O)NC2=S)C |
Product Overview
AC1M9IDE (CAS 680982-68-7), with molecular formula C22H21BrN2O3S and molecular weight 472.04562 g/mol. IUPAC: (5E)-5-[(3-bromo-4-propan-2-yloxyphenyl)methylidene]-1-(3,5-dimethylphenyl)-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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