HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 163607083Generated: November 4, 2026
1-[4-[4-[[3-[Methyl(sulfanylchloranuidyl)amino]pyrrolidin-1-yl]methyl]phenyl]phenyl]ethanone
https://huagongshe.com/en/chemical/163607083
Identifiers & Physical Properties
| Molecular formula | C20H24ClN2OS- |
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| Average molar mass | 375.9 g/mol |
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| SMILES | CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)CN3CCC(C3)N(C)[Cl-]S |
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| InChIKey | WHSNOQXKHKBWLY-UHFFFAOYSA-N |
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| PubChem CID | 163607083 |
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Chemical & Physical Properties
| XLogP | 4.1 |
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| Topological polar surface area | 24.6 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 25 |
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| Formal charge | -1 |
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| Complexity | 433 |
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![1-[4-[4-[[3-[Methyl(sulfanylchloranuidyl)amino]pyrrolidin-1-yl]methyl]phenyl]phenyl]ethanone molecular structure](/img/chemical/163607083.png)