HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86680098Generated: October 29, 2026
(R)-tert-butyl 2-(2,6-difluorophenyl)-4-(1-methyl-5-(4-(2,2,2-trifluoroethylamino)azepan-1-yl)-1H-pyrazol-4-ylcarbamoyl)thiazol-5-ylcarbamate
https://huagongshe.com/en/chemical/86680098
Identifiers & Physical Properties
| Molecular formula | C27H32F5N7O3S |
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| Average molar mass | 629.6 g/mol |
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| Monoisotopic mass | 629.22074989 g/mol |
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| SMILES | Cn1ncc(NC(=O)c2nc(-c3c(F)cccc3F)sc2NC(=O)OC(C)(C)C)c1N1CCC[C@@H](NCC(F)(F)F)CC1 |
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| InChIKey | GYKQTQVSZXWTOW-OAHLLOKOSA-N |
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| PubChem CID | 86680098 |
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Chemical & Physical Properties
| XLogP | 5.8 |
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| Topological polar surface area | 142 |
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| Hydrogen bond donors | 3 |
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| Hydrogen bond acceptors | 13 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 43 |
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| Formal charge | 0 |
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| Complexity | 951 |
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