HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86636980Generated: October 25, 2026
Tris(1,1-dimethylethyl) 2-(2-chloro-5-fluoro-6-{[2-methyl-2-(4-morpholinyl)propyl]amino}-4-pyrimidinyl)-1,1,2-hydrazinetricarboxylate
https://huagongshe.com/en/chemical/86636980
Identifiers & Physical Properties
| Molecular formula | C27H44ClFN6O7 |
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| Average molar mass | 619.1 g/mol |
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| SMILES | CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)c1nc(Cl)nc(NCC(C)(C)N2CCOCC2)c1F |
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| InChIKey | XGKGDFYGCOYLFM-UHFFFAOYSA-N |
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| PubChem CID | 86636980 |
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Chemical & Physical Properties
| XLogP | 5.2 |
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| Topological polar surface area | 136 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 12 |
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| Rotatable bonds | 11 |
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| Heavy atoms | 42 |
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| Formal charge | 0 |
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| Complexity | 919 |
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![Tris(1,1-dimethylethyl) 2-(2-chloro-5-fluoro-6-{[2-methyl-2-(4-morpholinyl)propyl]amino}-4-pyrimidinyl)-1,1,2-hydrazinetricarboxylate molecular structure](/img/chemical/86636980.png)