HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 67006993Generated: November 1, 2026
4-(1-{4-[2-(4-Benzyloxy-6-oxo-6H-pyridazin-1-yl)-acetyl]-phenyl}-ethyl)-piperazine-1-carboxylic acid tert-butyl ester
https://huagongshe.com/en/chemical/67006993
Identifiers & Physical Properties
| Molecular formula | C30H36N4O5 |
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| Average molar mass | 532.6 g/mol |
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| Monoisotopic mass | 532.26857026 g/mol |
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| SMILES | CC(c1ccc(C(=O)Cn2ncc(OCc3ccccc3)cc2=O)cc1)N1CCN(C(=O)OC(C)(C)C)CC1 |
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| InChIKey | GQMUSPDTJDIWQQ-UHFFFAOYSA-N |
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| PubChem CID | 67006993 |
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Chemical & Physical Properties
| XLogP | 3.5 |
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| Topological polar surface area | 91.8 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 10 |
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| Heavy atoms | 39 |
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| Formal charge | 0 |
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| Complexity | 920 |
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![4-(1-{4-[2-(4-Benzyloxy-6-oxo-6H-pyridazin-1-yl)-acetyl]-phenyl}-ethyl)-piperazine-1-carboxylic acid tert-butyl ester molecular structure](/img/chemical/67006993.png)