HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 59232103Generated: October 30, 2026
Tert-butyl 2-[(4-amino-5-bromopyrrolo[2,1-f][1,2,4]triazin-7-yl)carbonyl]morpholine-4-carboxylate
https://huagongshe.com/en/chemical/59232103
Identifiers & Physical Properties
| Molecular formula | C16H20BrN5O4 |
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| Average molar mass | 426.26 g/mol |
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| Monoisotopic mass | 425.06987 g/mol |
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| SMILES | CC(C)(C)OC(=O)N1CCOC(C(=O)c2cc(Br)c3c(N)ncnn23)C1 |
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| InChIKey | LCDMMZMAQJHYAI-UHFFFAOYSA-N |
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| PubChem CID | 59232103 |
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Chemical & Physical Properties
| XLogP | 1.4 |
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| Topological polar surface area | 112 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 4 |
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| Heavy atoms | 26 |
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| Formal charge | 0 |
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| Complexity | 557 |
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![Tert-butyl 2-[(4-amino-5-bromopyrrolo[2,1-f][1,2,4]triazin-7-yl)carbonyl]morpholine-4-carboxylate molecular structure](/img/chemical/59232103.png)