HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 71283307Generated: November 3, 2026
(S)-tert-butyl 6-((1-amino-1-oxopropan-2-yl)amino)-2-(4-(4-fluorophenoxy)phenyl)pyrimidine-4-carboxylate
https://huagongshe.com/en/chemical/71283307
Identifiers & Physical Properties
| Molecular formula | C24H25FN4O4 |
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| Average molar mass | 452.5 g/mol |
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| SMILES | C[C@H](Nc1cc(C(=O)OC(C)(C)C)nc(-c2ccc(Oc3ccc(F)cc3)cc2)n1)C(N)=O |
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| InChIKey | DDPXVSBGIRRKPI-AWEZNQCLSA-N |
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| PubChem CID | 71283307 |
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| ChEMBL | CHEMBL3927174 |
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Chemical & Physical Properties
| XLogP | 4.3 |
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| Topological polar surface area | 116 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 33 |
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| Formal charge | 0 |
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| Complexity | 657 |
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