HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 57504388Generated: October 31, 2026
(2S)-2-(1-(3-chloropyridin-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-N-(5-cyanopyridin-2-yl)-3-(2-hydroxyethoxy)propanamide
https://huagongshe.com/en/chemical/57504388
Identifiers & Physical Properties
| Molecular formula | C21H17ClN8O4 |
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| Average molar mass | 480.9 g/mol |
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| Monoisotopic mass | 480.1061287 g/mol |
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| SMILES | N#Cc1ccc(NC(=O)[C@H](COCCO)Oc2ncnc3c2cnn3-c2ncccc2Cl)nc1 |
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| InChIKey | LCRJVNQBJYIWTR-INIZCTEOSA-N |
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| PubChem CID | 57504388 |
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| ChEMBL | CHEMBL3221507 |
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Chemical & Physical Properties
| XLogP | 1.1 |
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| Topological polar surface area | 161 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 10 |
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| Rotatable bonds | 9 |
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| Heavy atoms | 34 |
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| Formal charge | 0 |
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| Complexity | 726 |
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![(2S)-2-(1-(3-chloropyridin-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-N-(5-cyanopyridin-2-yl)-3-(2-hydroxyethoxy)propanamide molecular structure](/img/chemical/57504388.png)