HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 60155100Generated: October 23, 2026
Tert-butyl 4-[6-[(4-methylsulfonylphenyl)methoxy]-3-pyridinyl]piperazine-1-carboxylate
https://huagongshe.com/en/chemical/60155100
Identifiers & Physical Properties
| Molecular formula | C22H29N3O5S |
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| Average molar mass | 447.5 g/mol |
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| SMILES | CC(C)(C)OC(=O)N1CCN(c2ccc(OCc3ccc(S(C)(=O)=O)cc3)nc2)CC1 |
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| InChIKey | CBNFLBDZRCZIJJ-UHFFFAOYSA-N |
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| PubChem CID | 60155100 |
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| ChEMBL | CHEMBL2086655 |
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Chemical & Physical Properties
| XLogP | 2.7 |
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| Topological polar surface area | 97.4 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 7 |
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| Heavy atoms | 31 |
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| Formal charge | 0 |
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| Complexity | 687 |
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| LogP (partition coefficient) | 3.1 |
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