HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86589340Generated: October 26, 2026
{5-Methoxy-2-[3-oxo-3-(3-pyridin-3-yl-phenyl)-propionylamino]-4-trifluoromethyl-phenyl}-carbamic acid tert-butyl ester
https://huagongshe.com/en/chemical/86589340
Identifiers & Physical Properties
| Molecular formula | C27H26F3N3O5 |
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| Average molar mass | 529.5 g/mol |
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| SMILES | COc1cc(NC(=O)OC(C)(C)C)c(NC(=O)CC(=O)c2cccc(-c3cccnc3)c2)cc1C(F)(F)F |
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| InChIKey | MMWXJTKXWBWDSL-UHFFFAOYSA-N |
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| PubChem CID | 86589340 |
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Chemical & Physical Properties
| XLogP | 5.1 |
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| Topological polar surface area | 107 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 9 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 38 |
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| Formal charge | 0 |
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| Complexity | 832 |
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![{5-Methoxy-2-[3-oxo-3-(3-pyridin-3-yl-phenyl)-propionylamino]-4-trifluoromethyl-phenyl}-carbamic acid tert-butyl ester molecular structure](/img/chemical/86589340.png)