HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 69964135Generated: October 31, 2026
(S)-4-(4-Amidinobenzoylamino)acetyl-3-[3-(4-amidinobenzoylamino)propyl]-2-oxopiperazine-1-acetic acid hydrochloride
https://huagongshe.com/en/chemical/69964135
Identifiers & Physical Properties
| Molecular formula | C27H33ClN8O6 |
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| Average molar mass | 601.1 g/mol |
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| Monoisotopic mass | 600.2211585 g/mol |
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| SMILES | Cl.N=C(N)c1ccc(C(=O)NCCC[C@H]2C(=O)N(CC(=O)O)CCN2C(=O)CNC(=O)c2ccc(C(=N)N)cc2)cc1 |
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| InChIKey | WZQQCGWGSWJAGC-BDQAORGHSA-N |
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| PubChem CID | 69964135 |
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Chemical & Physical Properties
| Topological polar surface area | 236 |
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| Hydrogen bond donors | 8 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 12 |
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| Heavy atoms | 42 |
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| Formal charge | 0 |
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| Complexity | 1,020 |
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![(S)-4-(4-Amidinobenzoylamino)acetyl-3-[3-(4-amidinobenzoylamino)propyl]-2-oxopiperazine-1-acetic acid hydrochloride molecular structure](/img/chemical/69964135.png)