HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19829284Generated: November 3, 2026
1-{2-[Acetyl-(2-methoxy-3-octadecylcarbamoyloxy-propoxycarbonyl)-amino]-ethyl}-1-methyl-pyrrolidinium; iodide
https://huagongshe.com/en/chemical/19829284
Identifiers & Physical Properties
| CAS No. | 786600-53-1 |
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| Molecular formula | C33H64N3O6+ |
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| Average molar mass | 598.9 g/mol |
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| Monoisotopic mass | 598.47951177 g/mol |
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| SMILES | CCCCCCCCCCCCCCCCCCNC(=O)OCC(COC(=O)N(CC[N+]1(C)CCCC1)C(C)=O)OC |
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| InChIKey | HGEBILBDIFGUDY-UHFFFAOYSA-O |
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| PubChem CID | 19829284 |
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| ChEMBL | CHEMBL1182953 |
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| DTXSID | DTXSID301124397 |
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Chemical & Physical Properties
| XLogP | 8.9 |
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| Topological polar surface area | 94.2 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 27 |
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| Heavy atoms | 42 |
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| Formal charge | 1 |
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| Complexity | 714 |
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![1-{2-[Acetyl-(2-methoxy-3-octadecylcarbamoyloxy-propoxycarbonyl)-amino]-ethyl}-1-methyl-pyrrolidinium; iodide molecular structure](/img/chemical/19829284.png)