HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19085173Generated: October 27, 2026
4-(3-(2-Chlorobenzoyl)-5-ethylthiophen-2-yl)-3-hydroxymethyl-5-methyl[1,2,4]triazole
https://huagongshe.com/en/chemical/19085173
Identifiers & Physical Properties
| Molecular formula | C17H16ClN3O2S |
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| Average molar mass | 361.8 g/mol |
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| SMILES | CCc1cc(C(=O)c2ccccc2Cl)c(-n2c(C)nnc2CO)s1 |
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| InChIKey | VWNUCFNZAFGPCK-UHFFFAOYSA-N |
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| PubChem CID | 19085173 |
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Chemical & Physical Properties
| XLogP | 3.5 |
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| Topological polar surface area | 96.3 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 24 |
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| Formal charge | 0 |
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| Complexity | 456 |
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![4-(3-(2-Chlorobenzoyl)-5-ethylthiophen-2-yl)-3-hydroxymethyl-5-methyl[1,2,4]triazole molecular structure](/img/chemical/19085173.png)