HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 9809123Generated: October 27, 2026
N-[3-{2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy}-1-methyl-4-(4-methylphenyl)-1H-pyrazol-5-yl]4-(tert-pentyl)benzenesulfonamide
https://huagongshe.com/en/chemical/9809123
Identifiers & Physical Properties
| Molecular formula | C28H32BrN5O4S |
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| Average molar mass | 614.6 g/mol |
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| SMILES | CCC(C)(C)c1ccc(S(=O)(=O)Nc2c(-c3ccc(C)cc3)c(OCCOc3ncc(Br)cn3)nn2C)cc1 |
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| InChIKey | AFKLPFKCNJKOMB-UHFFFAOYSA-N |
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| PubChem CID | 9809123 |
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Chemical & Physical Properties
| XLogP | 6.6 |
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| Topological polar surface area | 117 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 11 |
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| Heavy atoms | 39 |
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| Formal charge | 0 |
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| Complexity | 851 |
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![N-[3-{2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy}-1-methyl-4-(4-methylphenyl)-1H-pyrazol-5-yl]4-(tert-pentyl)benzenesulfonamide molecular structure](/img/chemical/9809123.png)