HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86636931Generated: October 26, 2026
((2R)-2-(Cyclopentylmethyl)-3-{2-[2-ethyl-5-fluoro-6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]hydrazino}-3-oxopropyl)[(phenylmethyl)oxy]formamide
https://huagongshe.com/en/chemical/86636931
Identifiers & Physical Properties
| Molecular formula | C28H40FN7O3 |
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| Average molar mass | 541.7 g/mol |
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| Monoisotopic mass | 541.31766633 g/mol |
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| SMILES | CCc1nc(NNC(=O)[C@H](CC2CCCC2)CN(C=O)OCc2ccccc2)c(F)c(N2CCN(C)CC2)n1 |
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| InChIKey | VGDURUOJFWONIZ-HSZRJFAPSA-N |
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| PubChem CID | 86636931 |
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Chemical & Physical Properties
| XLogP | 4.8 |
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| Topological polar surface area | 103 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 9 |
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| Rotatable bonds | 12 |
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| Heavy atoms | 39 |
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| Formal charge | 0 |
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| Complexity | 745 |
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![((2R)-2-(Cyclopentylmethyl)-3-{2-[2-ethyl-5-fluoro-6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]hydrazino}-3-oxopropyl)[(phenylmethyl)oxy]formamide molecular structure](/img/chemical/86636931.png)