HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 2906882Generated: November 4, 2026
4-[(5-Bromo-2-methoxyphenyl)methylidene]-2-methylsulfanyl-1,3-thiazol-5-one
https://huagongshe.com/en/chemical/2906882
Identifiers & Physical Properties
| CAS No. | 430459-57-7 |
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| Molecular formula | C12H10BrNO2S2 |
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| Average molar mass | 344.3 g/mol |
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| Monoisotopic mass | 342.93363 g/mol |
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| SMILES | COc1ccc(Br)cc1C=C1N=C(SC)SC1=O |
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| InChIKey | ZFFSRKSCKBCCIT-UHFFFAOYSA-N |
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| PubChem CID | 2906882 |
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| DTXSID | DTXSID40387741 |
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Chemical & Physical Properties
| XLogP | 4.1 |
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| Topological polar surface area | 89.3 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 18 |
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| Formal charge | 0 |
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| Complexity | 398 |
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![4-[(5-Bromo-2-methoxyphenyl)methylidene]-2-methylsulfanyl-1,3-thiazol-5-one molecular structure](/img/chemical/2906882.png)