HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 5479250Generated: November 4, 2026
L-Phenylalaninamide, N-(5-((3,3-dimethyl-1-oxobutyl)amino)-4-hydroxy-1-oxo-6-phenyl-2-(phenylmethyl)hexyl)-L-leucyl-, (2R-(2R*,4S*,5S*))-
https://huagongshe.com/en/chemical/5479250
Identifiers & Physical Properties
| CAS No. | 129252-79-5 |
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| Molecular formula | C40H54N4O5 |
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| Average molar mass | 670.9 g/mol |
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| Monoisotopic mass | 670.40942084 g/mol |
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| SMILES | CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)CC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |
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| InChIKey | SSDHDCHQNPWZLQ-DNOAQWIPSA-N |
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| PubChem CID | 5479250 |
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| ChEMBL | CHEMBL3143353 |
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| DTXSID | DTXSID50156127 |
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Chemical & Physical Properties
| XLogP | 6.2 |
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| Topological polar surface area | 151 |
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| Hydrogen bond donors | 5 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 19 |
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| Heavy atoms | 49 |
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| Formal charge | 0 |
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| Complexity | 1,020 |
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