HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 136334113Generated: October 27, 2026
5-methyl-2-(1-naphthylmethyl)-3-(4-pyridinyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
https://huagongshe.com/en/chemical/136334113
Identifiers & Physical Properties
| Molecular formula | C22H17N5O2 |
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| Average molar mass | 383.4 g/mol |
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| SMILES | Cn1c(=O)[nH]c2nn(Cc3cccc4ccccc34)c(-c3ccncc3)c2c1=O |
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| InChIKey | OXFPSQQHHIXMOD-UHFFFAOYSA-N |
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| PubChem CID | 136334113 |
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Chemical & Physical Properties
| XLogP | 2.7 |
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| Topological polar surface area | 80.1 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 29 |
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| Formal charge | 0 |
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| Complexity | 637 |
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![5-methyl-2-(1-naphthylmethyl)-3-(4-pyridinyl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione molecular structure](/img/chemical/136334113.png)