HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 78318758Generated: October 29, 2026
(4aR,7aS)-6-(5-Fluoropyrimidin-2-yl)-7a-phenyl-4,4a,5,7-tetrahydropyrrolo[3,4-d][1,3]thiazin-2-amine hydrochloride
https://huagongshe.com/en/chemical/78318758
Identifiers & Physical Properties
| Molecular formula | C16H17ClFN5S |
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| Average molar mass | 365.9 g/mol |
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| SMILES | Cl.NC1=N[C@@]2(c3ccccc3)CN(c3ncc(F)cn3)C[C@H]2CS1 |
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| InChIKey | OUUYOATXWGWJFR-CVHDTDHSSA-N |
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| PubChem CID | 78318758 |
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Chemical & Physical Properties
| Topological polar surface area | 92.7 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 2 |
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| Heavy atoms | 24 |
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| Formal charge | 0 |
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| Complexity | 461 |
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![(4aR,7aS)-6-(5-Fluoropyrimidin-2-yl)-7a-phenyl-4,4a,5,7-tetrahydropyrrolo[3,4-d][1,3]thiazin-2-amine hydrochloride molecular structure](/img/chemical/78318758.png)