HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 18613402Generated: November 2, 2026
8-(2-Fluoro-phenyl)-4-(3-imidazol-1-yl-phenyl)-7-(2,2,2-trifluoro-ethoxy)-1,3-dihydro-benzo[b][1,4]diazepin-2-one
https://huagongshe.com/en/chemical/18613402
Identifiers & Physical Properties
| Molecular formula | C26H18F4N4O2 |
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| Average molar mass | 494.4 g/mol |
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| SMILES | O=C1CC(c2cccc(-n3ccnc3)c2)=Nc2cc(OCC(F)(F)F)c(-c3ccccc3F)cc2N1 |
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| InChIKey | NWIYLCHBJCUSCI-UHFFFAOYSA-N |
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| PubChem CID | 18613402 |
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Chemical & Physical Properties
| XLogP | 5 |
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| Topological polar surface area | 68.5 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 36 |
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| Formal charge | 0 |
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| Complexity | 809 |
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![8-(2-Fluoro-phenyl)-4-(3-imidazol-1-yl-phenyl)-7-(2,2,2-trifluoro-ethoxy)-1,3-dihydro-benzo[b][1,4]diazepin-2-one molecular structure](/img/chemical/18613402.png)