HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86636926Generated: October 27, 2026
[(2R)-3-(2-{2-chloro-5-fluoro-6-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]hept-2-yl]-4-pyrimidinyl}hydrazino)-2-(cyclopentyl methyl)-3-oxopropyl][(phenylmethyl)oxy]formamide
https://huagongshe.com/en/chemical/86636926
Identifiers & Physical Properties
| Molecular formula | C27H35ClFN7O3 |
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| Average molar mass | 560.1 g/mol |
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| Monoisotopic mass | 559.2473939 g/mol |
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| SMILES | CN1C[C@@H]2C[C@H]1CN2c1nc(Cl)nc(NNC(=O)[C@H](CC2CCCC2)CN(C=O)OCc2ccccc2)c1F |
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| InChIKey | NKANMRPZGWUSPJ-FSSWDIPSSA-N |
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| PubChem CID | 86636926 |
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Chemical & Physical Properties
| XLogP | 5.2 |
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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 | 11 |
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| Heavy atoms | 39 |
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| Formal charge | 0 |
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| Complexity | 818 |
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![[(2R)-3-(2-{2-chloro-5-fluoro-6-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]hept-2-yl]-4-pyrimidinyl}hydrazino)-2-(cyclopentyl methyl)-3-oxopropyl][(phenylmethyl)oxy]formamide molecular structure](/img/chemical/86636926.png)