HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 76166166Generated: October 26, 2026
1-[[5-[[4-(N'-benzoylcarbamimidoyl)anilino]-[2-fluoro-3-(2-hydroxyethoxy)-5-methoxyphenyl]methyl]-2-pyrimidin-2-yl-1,2,4-triazol-3-yl]oxy]propyl cyclohexyl carbonate
https://huagongshe.com/en/chemical/76166166
Identifiers & Physical Properties
| Molecular formula | C40H43FN8O8 |
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| Average molar mass | 782.8 g/mol |
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| SMILES | CCC(OC(=O)OC1CCCCC1)Oc1nc(C(Nc2ccc(C(N)=NC(=O)c3ccccc3)cc2)c2cc(OC)cc(OCCO)c2F)nn1-c1ncccn1 |
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| InChIKey | GDTPLDFJAVJGDW-UHFFFAOYSA-N |
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| PubChem CID | 76166166 |
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Chemical & Physical Properties
| XLogP | 7.5 |
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| Topological polar surface area | 207 |
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| Hydrogen bond donors | 3 |
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| Hydrogen bond acceptors | 14 |
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| Rotatable bonds | 18 |
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| Heavy atoms | 57 |
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| Formal charge | 0 |
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| Complexity | 1,260 |
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![1-[[5-[[4-(N'-benzoylcarbamimidoyl)anilino]-[2-fluoro-3-(2-hydroxyethoxy)-5-methoxyphenyl]methyl]-2-pyrimidin-2-yl-1,2,4-triazol-3-yl]oxy]propyl cyclohexyl carbonate molecular structure](/img/chemical/76166166.png)