HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 5225737Generated: November 3, 2026
2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide
https://huagongshe.com/en/chemical/5225737
Identifiers & Physical Properties
| CAS No. | 6252-80-8 |
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| Molecular formula | C15H14N2O4S2 |
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| Average molar mass | 350.4 g/mol |
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| Monoisotopic mass | 350.03949928 g/mol |
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| SMILES | C#CCn1c(=NC(=O)CS(=O)(=O)C(C)=O)sc2cc(C)ccc21 |
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| InChIKey | MVWOTGCSHSWLNZ-UHFFFAOYSA-N |
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| PubChem CID | 5225737 |
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| DTXSID | DTXSID00411415 |
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Chemical & Physical Properties
| XLogP | 1.6 |
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| Topological polar surface area | 118 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 4 |
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| Heavy atoms | 23 |
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| Formal charge | 0 |
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| Complexity | 684 |
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![2-(Ethanesulfonyl)-N-[6-methyl-3-(prop-2-yn-1-yl)-1,3-benzothiazol-2(3H)-ylidene]acetamide molecular structure](/img/chemical/5225737.png)