HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 67775752Generated: October 27, 2026
(R)-tert-butyl 1-(3-bromo-4-cyanophenylamino)-3-methoxypropan-2-ylcarbamate
https://huagongshe.com/en/chemical/67775752
Identifiers & Physical Properties
| Molecular formula | C16H22BrN3O3 |
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| Average molar mass | 384.27 g/mol |
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| Monoisotopic mass | 383.08445 g/mol |
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| SMILES | COC[C@@H](CNc1ccc(C#N)c(Br)c1)NC(=O)OC(C)(C)C |
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| InChIKey | HXUJBKFKKABFDX-CYBMUJFWSA-N |
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| PubChem CID | 67775752 |
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Chemical & Physical Properties
| XLogP | 2.9 |
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| Topological polar surface area | 83.4 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 8 |
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| Heavy atoms | 23 |
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| Formal charge | 0 |
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| Complexity | 430 |
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