HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 20199178Generated: October 27, 2026
N-[3-[3-[(Dimethylamino)methyl]phenoxy]propyl]-1-methyl-3-[(methylsulphonyl)methyl]-1H-1,2,4-triazol-5-amine
https://huagongshe.com/en/chemical/20199178
Identifiers & Physical Properties
| Molecular formula | C17H27N5O3S |
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| Average molar mass | 381.5 g/mol |
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| Monoisotopic mass | 381.18346091 g/mol |
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| SMILES | CN(C)Cc1cccc(OCCCNc2nc(CS(C)(=O)=O)nn2C)c1 |
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| InChIKey | JKOJWFMRFXJSMR-UHFFFAOYSA-N |
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| PubChem CID | 20199178 |
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Chemical & Physical Properties
| XLogP | 1.4 |
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| Topological polar surface area | 97.7 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 10 |
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| Heavy atoms | 26 |
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| Formal charge | 0 |
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| Complexity | 511 |
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![N-[3-[3-[(Dimethylamino)methyl]phenoxy]propyl]-1-methyl-3-[(methylsulphonyl)methyl]-1H-1,2,4-triazol-5-amine molecular structure](/img/chemical/20199178.png)