HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 136161663Generated: October 28, 2026
N-[1-(3-methylthio-4,5-dihydro-5-oxo-1,2,4-triazin-6-yl)ethyl]-3-methylbutyramide
https://huagongshe.com/en/chemical/136161663
Identifiers & Physical Properties
| Molecular formula | C11H18N4O2S |
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| Average molar mass | 270.35 g/mol |
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| Monoisotopic mass | 270.115047 g/mol |
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| SMILES | CSc1nnc(C(C)NC(=O)CC(C)C)c(=O)[nH]1 |
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| InChIKey | XPECXZPBBAUCIP-UHFFFAOYSA-N |
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| PubChem CID | 136161663 |
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Chemical & Physical Properties
| XLogP | 1.8 |
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| Topological polar surface area | 108 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 18 |
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| Formal charge | 0 |
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| Complexity | 404 |
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![N-[1-(3-methylthio-4,5-dihydro-5-oxo-1,2,4-triazin-6-yl)ethyl]-3-methylbutyramide molecular structure](/img/chemical/136161663.png)