HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 58232113Generated: October 27, 2026
(R)-1-(3-Chloro-4-trifluoromethyl-phenyl)-4-[4-((S)-4-hydroxy-6-aza-spiro[2.5]oct-6-yl)-4-oxo-butyl]-2-methyl-[1,4]diazepan-5-one
https://huagongshe.com/en/chemical/58232113
Identifiers & Physical Properties
| Molecular formula | C24H31ClF3N3O3 |
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| Average molar mass | 502 g/mol |
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| Monoisotopic mass | 501.200604 g/mol |
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| SMILES | C[C@@H]1CN(CCCC(=O)N2CCC3(CC3)[C@H](O)C2)C(=O)CCN1c1ccc(C(F)(F)F)c(Cl)c1 |
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| InChIKey | VYDVJHSTFYOOOO-OXQOHEQNSA-N |
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| PubChem CID | 58232113 |
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Chemical & Physical Properties
| XLogP | 3.1 |
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| Topological polar surface area | 64.1 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 34 |
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| Formal charge | 0 |
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| Complexity | 763 |
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![(R)-1-(3-Chloro-4-trifluoromethyl-phenyl)-4-[4-((S)-4-hydroxy-6-aza-spiro[2.5]oct-6-yl)-4-oxo-butyl]-2-methyl-[1,4]diazepan-5-one molecular structure](/img/chemical/58232113.png)