HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 9851963Generated: October 27, 2026
8-{4-[4-(1-Benzenesulfonyl-1H-indol-5-ylamino)-quinazolin-6-yl]-benzyl}-8-aza-bicyclo[3.2.1]octan-3-ol
https://huagongshe.com/en/chemical/9851963
Identifiers & Physical Properties
| Molecular formula | C36H33N5O3S |
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| Average molar mass | 615.7 g/mol |
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| SMILES | O=S(=O)(c1ccccc1)n1ccc2cc(Nc3ncnc4ccc(-c5ccc(CN6C7CCC6CC(O)C7)cc5)cc34)ccc21 |
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| InChIKey | CVJSWLMXPWFINH-UHFFFAOYSA-N |
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| PubChem CID | 9851963 |
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Chemical & Physical Properties
| XLogP | 6.7 |
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| Topological polar surface area | 109 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 7 |
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| Heavy atoms | 45 |
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| Formal charge | 0 |
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| Complexity | 1,090 |
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![8-{4-[4-(1-Benzenesulfonyl-1H-indol-5-ylamino)-quinazolin-6-yl]-benzyl}-8-aza-bicyclo[3.2.1]octan-3-ol molecular structure](/img/chemical/9851963.png)