HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 508591Generated: November 3, 2026
methyl (2S)-2-[isobutyl(p-tolylsulfonyl)amino]-6-[[(2S)-3-phenyl-2-(p-tolylsulfonylamino)propanoyl]amino]hexanoate
https://huagongshe.com/en/chemical/508591
Identifiers & Physical Properties
| Molecular formula | C34H45N3O7S2 |
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| Average molar mass | 671.9 g/mol |
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| SMILES | COC(=O)[C@H](CCCCNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C)cc1)N(CC(C)C)S(=O)(=O)c1ccc(C)cc1 |
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| InChIKey | DLYRKZYLWFWOGE-ACHIHNKUSA-N |
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| PubChem CID | 508591 |
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Chemical & Physical Properties
| XLogP | 6.2 |
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| Topological polar surface area | 156 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 9 |
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| Rotatable bonds | 18 |
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| Heavy atoms | 46 |
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| Formal charge | 0 |
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| Complexity | 1,140 |
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![methyl (2S)-2-[isobutyl(p-tolylsulfonyl)amino]-6-[[(2S)-3-phenyl-2-(p-tolylsulfonylamino)propanoyl]amino]hexanoate molecular structure](/img/chemical/508591.png)