HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 166314Generated: October 28, 2026
5-[[2-[(2-Hydroxyacetyl)amino]-4-[[3-[(2-hydroxyacetyl)amino]-4-[(4-methyl-3-sulfophenyl)diazenyl]phenyl]carbamoylamino]phenyl]diazenyl]-2-methylbenzenesulfonic acid
https://huagongshe.com/en/chemical/166314
Identifiers & Physical Properties
| Molecular formula | C31H30N8O11S2 |
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| Average molar mass | 754.8 g/mol |
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| Monoisotopic mass | 754.14754615 g/mol |
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| SMILES | Cc1ccc(N=Nc2ccc(NC(=O)Nc3ccc(N=Nc4ccc(C)c(S(=O)(=O)O)c4)c(NC(=O)CO)c3)cc2NC(=O)CO)cc1S(=O)(=O)O |
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| InChIKey | IRJYTEISOYWSIR-UHFFFAOYSA-N |
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| PubChem CID | 166314 |
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Chemical & Physical Properties
| XLogP | 1.3 |
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| Topological polar surface area | 315 |
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| Hydrogen bond donors | 8 |
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| Hydrogen bond acceptors | 15 |
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| Rotatable bonds | 12 |
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| Heavy atoms | 52 |
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| Formal charge | 0 |
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| Complexity | 1,410 |
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![5-[[2-[(2-Hydroxyacetyl)amino]-4-[[3-[(2-hydroxyacetyl)amino]-4-[(4-methyl-3-sulfophenyl)diazenyl]phenyl]carbamoylamino]phenyl]diazenyl]-2-methylbenzenesulfonic acid molecular structure](/img/chemical/166314.png)