HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 66577607Generated: October 27, 2026
(1-Benzyl-piperidin-4-yl)-[5-(4-bromo-phenyl)-3-methyl-isoxazol-4-yl]-amine
https://huagongshe.com/en/chemical/66577607
Identifiers & Physical Properties
| Molecular formula | C22H24BrN3O |
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| Average molar mass | 426.3 g/mol |
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| Monoisotopic mass | 425.11027 g/mol |
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| SMILES | Cc1noc(-c2ccc(Br)cc2)c1NC1CCN(Cc2ccccc2)CC1 |
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| InChIKey | KNBUSTRHAMKMTM-UHFFFAOYSA-N |
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| PubChem CID | 66577607 |
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Chemical & Physical Properties
| XLogP | 5.2 |
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| Topological polar surface area | 41.3 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 27 |
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| Formal charge | 0 |
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| Complexity | 443 |
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![(1-Benzyl-piperidin-4-yl)-[5-(4-bromo-phenyl)-3-methyl-isoxazol-4-yl]-amine molecular structure](/img/chemical/66577607.png)