HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 118009839Generated: October 29, 2026
4-(1-(1-(3-methoxy-4-((6-(trifluoromethyl)pyridin-3-yl)methoxy)phenyl)ethyl)-1H-benzo[d]imidazol-5-yl)but-3-yn-1-ol
https://huagongshe.com/en/chemical/118009839
Identifiers & Physical Properties
| Molecular formula | C27H24F3N3O3 |
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| Average molar mass | 495.5 g/mol |
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| Monoisotopic mass | 495.17697612 g/mol |
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| SMILES | COc1cc(C(C)n2cnc3cc(C#CCCO)ccc32)ccc1OCc1ccc(C(F)(F)F)nc1 |
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| InChIKey | IHVVNQIYQOLNQR-UHFFFAOYSA-N |
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| PubChem CID | 118009839 |
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| ChEMBL | CHEMBL3678296 |
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Chemical & Physical Properties
| XLogP | 4.7 |
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| Topological polar surface area | 69.4 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 8 |
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| Heavy atoms | 36 |
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| Formal charge | 0 |
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| Complexity | 770 |
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![4-(1-(1-(3-methoxy-4-((6-(trifluoromethyl)pyridin-3-yl)methoxy)phenyl)ethyl)-1H-benzo[d]imidazol-5-yl)but-3-yn-1-ol molecular structure](/img/chemical/118009839.png)