HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 90231663Generated: October 29, 2026
[(S)-1-((S)-2-{(2S,4S)-4-Amino-2-[(S)-(1,2,3,4-tetrahydro-naphthalen-1-yl)carbamoyl]-pyrrolidin-1-yl}-1-cyclohexyl-2-oxo-ethylcarbamoyl)-ethyl]-methyl-carbamic acid tert-butyl ester
https://huagongshe.com/en/chemical/90231663
Identifiers & Physical Properties
| Molecular formula | C32H49N5O5 |
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| Average molar mass | 583.8 g/mol |
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| SMILES | C[C@@H](C(=O)N[C@H](C(=O)N1C[C@@H](N)C[C@H]1C(=O)N[C@H]1CCCc2ccccc21)C1CCCCC1)N(C)C(=O)OC(C)(C)C |
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| InChIKey | MQXRDFRHLFKZNZ-UIGMUVSQSA-N |
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| PubChem CID | 90231663 |
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Chemical & Physical Properties
| XLogP | 3.7 |
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| Topological polar surface area | 134 |
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| Hydrogen bond donors | 3 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 42 |
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| Formal charge | 0 |
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| Complexity | 977 |
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![[(S)-1-((S)-2-{(2S,4S)-4-Amino-2-[(S)-(1,2,3,4-tetrahydro-naphthalen-1-yl)carbamoyl]-pyrrolidin-1-yl}-1-cyclohexyl-2-oxo-ethylcarbamoyl)-ethyl]-methyl-carbamic acid tert-butyl ester molecular structure](/img/chemical/90231663.png)