HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 123716601Generated: October 23, 2026
1-[3,5-Bis(trifluoromethyl)phenyl]-3-[4-(4-fluorophenyl)-1-(1,3-thiazole-2-carbonyl)pyrrolidin-3-yl]-1,3-dimethylurea
https://huagongshe.com/en/chemical/123716601
Identifiers & Physical Properties
| Molecular formula | C25H21F7N4O2S |
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| Average molar mass | 574.5 g/mol |
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| SMILES | CN(C(=O)N(C)C1CN(C(=O)c2nccs2)CC1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 |
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| InChIKey | PFBBOFQQKXKGQC-UHFFFAOYSA-N |
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| PubChem CID | 123716601 |
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Chemical & Physical Properties
| XLogP | 5.3 |
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| Topological polar surface area | 85 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 11 |
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| Rotatable bonds | 4 |
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| Heavy atoms | 39 |
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| Formal charge | 0 |
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| Complexity | 861 |
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![1-[3,5-Bis(trifluoromethyl)phenyl]-3-[4-(4-fluorophenyl)-1-(1,3-thiazole-2-carbonyl)pyrrolidin-3-yl]-1,3-dimethylurea molecular structure](/img/chemical/123716601.png)