HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 58748708Generated: October 28, 2026
[4-(2-Hydroxy-ethyl)-piperazin-1-yl]-[5-(5-nitro-pyrimidin-2-ylamino)-Pyridin-2-yl]methanone
https://huagongshe.com/en/chemical/58748708
Identifiers & Physical Properties
| Molecular formula | C16H19N7O4 |
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| Average molar mass | 373.37 g/mol |
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| SMILES | O=C(c1ccc(Nc2ncc([N+](=O)[O-])cn2)cn1)N1CCN(CCO)CC1 |
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| InChIKey | BQTJTKYDRHSYJX-UHFFFAOYSA-N |
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| PubChem CID | 58748708 |
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Chemical & Physical Properties
| XLogP | -0.2 |
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| Topological polar surface area | 140 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 9 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 27 |
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| Formal charge | 0 |
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| Complexity | 501 |
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![[4-(2-Hydroxy-ethyl)-piperazin-1-yl]-[5-(5-nitro-pyrimidin-2-ylamino)-Pyridin-2-yl]methanone molecular structure](/img/chemical/58748708.png)