HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 88198442Generated: October 30, 2026
benzhydryl (6R,7R)-7-[[(2Z)-2-(2-amino-5-chloro-1,3-thiazol-4-yl)-2-cyclopent-2-en-1-yloxyiminoacetyl]amino]-8-oxo-3-(1H-pyrazol-4-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
https://huagongshe.com/en/chemical/88198442
Identifiers & Physical Properties
| Molecular formula | C34H30ClN7O5S3 |
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| Average molar mass | 748.3 g/mol |
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| Monoisotopic mass | 747.1159083 g/mol |
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| SMILES | Nc1nc(/C(=N/OC2C=CCC2)C(=O)N[C@@H]2C(=O)N3C(C(=O)OC(c4ccccc4)c4ccccc4)=C(SCc4cn[nH]c4)CS[C@H]23)c(Cl)s1 |
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| InChIKey | IJXXTMJPHNEZNO-UFYRBOOHSA-N |
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| PubChem CID | 88198442 |
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Chemical & Physical Properties
| XLogP | 6.1 |
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| Topological polar surface area | 244 |
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| Hydrogen bond donors | 3 |
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| Hydrogen bond acceptors | 12 |
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| Rotatable bonds | 13 |
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| Heavy atoms | 50 |
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| Formal charge | 0 |
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| Complexity | 1,340 |
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![benzhydryl (6R,7R)-7-[[(2Z)-2-(2-amino-5-chloro-1,3-thiazol-4-yl)-2-cyclopent-2-en-1-yloxyiminoacetyl]amino]-8-oxo-3-(1H-pyrazol-4-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate molecular structure](/img/chemical/88198442.png)