AC1O3HPT
(6Z)-6-[(3-bromo-4-methoxyphenyl)methylidene]-2-(2-cyclohexylethyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: (Z)-6-(3-bromo-4-methoxybenzylidene)-2-(2-cyclohexylethyl)-5-imino-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one|(6Z)-6-[(3-bromo-4-methoxyphenyl)methylidene]-2-(2-cyclohexylethyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
CAS: 848686-73-7
| Molecular Formula | C21H23BrN4O2S |
|---|---|
| Molecular Weight | 474.0725 g/mol |
| LogP | 5.43737 |
| Topological Polar Surface Area | 78.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.0725 |
| Monoisotopic Mass | 474.0725 |
| Heavy Atoms | 29 |
| Complexity | 934.6088 |
Chemical Identifiers
| CAS Number | 848686-73-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C\2/C(=N)N3C(=NC2=O)SC(=N3)CCC4CCCCC4)Br |
Product Overview
AC1O3HPT (CAS 848686-73-7), with molecular formula C21H23BrN4O2S and molecular weight 474.0725 g/mol. IUPAC: (6Z)-6-[(3-bromo-4-methoxyphenyl)methylidene]-2-(2-cyclohexylethyl)-5-imino-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
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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