HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 58421663Generated: October 29, 2026
4-[4-Fluoro-2-((1S,2S)-2-methoxy-cyclohexyloxy)-phenylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid (3-dimethylamino-propyl)-amide
https://huagongshe.com/en/chemical/58421663
Identifiers & Physical Properties
| Molecular formula | C26H34FN5O3S |
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| Average molar mass | 515.6 g/mol |
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| Monoisotopic mass | 515.2366393 g/mol |
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| SMILES | CO[C@H]1CCCC[C@@H]1Oc1cc(F)ccc1Nc1ncnc2sc(C(=O)NCCCN(C)C)c(C)c12 |
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| InChIKey | FWUPNQLNAXTPRK-PMACEKPBSA-N |
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| PubChem CID | 58421663 |
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Chemical & Physical Properties
| XLogP | 5.1 |
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| Topological polar surface area | 117 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 9 |
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| Rotatable bonds | 10 |
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| Heavy atoms | 36 |
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| Formal charge | 0 |
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| Complexity | 706 |
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![4-[4-Fluoro-2-((1S,2S)-2-methoxy-cyclohexyloxy)-phenylamino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid (3-dimethylamino-propyl)-amide molecular structure](/img/chemical/58421663.png)