HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 16005201Generated: October 27, 2026
7-(4-chlorophenyl)-8-(3,5-difluoro-4-(hydroxymethyl)phenyl)-2-((2-methyl-6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
https://huagongshe.com/en/chemical/16005201
Identifiers & Physical Properties
| Molecular formula | C27H18ClF5N4O2 |
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| Average molar mass | 560.9 g/mol |
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| Monoisotopic mass | 560.1038443 g/mol |
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| SMILES | Cc1nc(C(F)(F)F)ccc1Cn1nc2c(-c3cc(F)c(CO)c(F)c3)c(-c3ccc(Cl)cc3)ccn2c1=O |
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| InChIKey | CBBPQCQBLGFQRW-UHFFFAOYSA-N |
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| PubChem CID | 16005201 |
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Chemical & Physical Properties
| XLogP | 4.7 |
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| Topological polar surface area | 69 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 9 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 39 |
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| Formal charge | 0 |
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| Complexity | 1,020 |
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![7-(4-chlorophenyl)-8-(3,5-difluoro-4-(hydroxymethyl)phenyl)-2-((2-methyl-6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one molecular structure](/img/chemical/16005201.png)