HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19081252Generated: October 27, 2026
(3RS)-3-amino-1-(benzo-thiazol-2-yl)methyl-2,3-dihydro-5-(2-fluorophenyl)-1H-1,4-benzo-diazepin-2-one
https://huagongshe.com/en/chemical/19081252
Identifiers & Physical Properties
| Molecular formula | C23H17FN4OS |
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| Average molar mass | 416.5 g/mol |
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| Monoisotopic mass | 416.11071051 g/mol |
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| SMILES | NC1N=C(c2ccccc2F)c2ccccc2N(Cc2nc3ccccc3s2)C1=O |
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| InChIKey | ZNQAOKMIKHLETF-UHFFFAOYSA-N |
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| PubChem CID | 19081252 |
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Chemical & Physical Properties
| XLogP | 3.9 |
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| Topological polar surface area | 99.8 |
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| Hydrogen bond donors | 1 |
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| Hydrogen bond acceptors | 6 |
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| Rotatable bonds | 3 |
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| Heavy atoms | 30 |
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| Formal charge | 0 |
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| Complexity | 676 |
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