HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19084936Generated: October 27, 2026
S-pyridin-2-yl 10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-17-carbothioate
https://huagongshe.com/en/chemical/19084936
Identifiers & Physical Properties
| Molecular formula | C25H31NO2S |
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| Average molar mass | 409.6 g/mol |
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| SMILES | CC12CCC(=O)C=C1CCC1C2CCC2(C)C(C(=O)Sc3ccccn3)CCC12 |
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| InChIKey | YQHJEBPJZIDKSM-UHFFFAOYSA-N |
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| PubChem CID | 19084936 |
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Chemical & Physical Properties
| XLogP | 5.4 |
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| Topological polar surface area | 72.3 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 29 |
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| Formal charge | 0 |
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| Complexity | 732 |
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![S-pyridin-2-yl 10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-17-carbothioate molecular structure](/img/chemical/19084936.png)