HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 66961663Generated: October 29, 2026
5-chloro-2-(3-methoxy-4-(4-methyl-1H-imidazol-1-yl)benzylidene)valeric acid ((1S)-1-(3-fluorophenyl)ethyl)amide
https://huagongshe.com/en/chemical/66961663
Identifiers & Physical Properties
| Molecular formula | C25H27ClFN3O2 |
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| Average molar mass | 455.9 g/mol |
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| Monoisotopic mass | 455.177583 g/mol |
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| SMILES | COc1cc(C=C(CCCCl)C(=O)N[C@@H](C)c2cccc(F)c2)ccc1-n1cnc(C)c1 |
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| InChIKey | ODFOUWLINRNAGE-SFHVURJKSA-N |
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| PubChem CID | 66961663 |
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Chemical & Physical Properties
| XLogP | 5 |
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| Topological polar surface area | 56.2 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 32 |
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| Formal charge | 0 |
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| Complexity | 634 |
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