HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 44603268Generated: October 26, 2026
7-(4-Cyclopropyl-2-fluoro-phenylamino)-benzo[d]isothiazole-6-carboxylic acid ((R)-2,3-dihydroxy-propoxy)-amide
https://huagongshe.com/en/chemical/44603268
Identifiers & Physical Properties
| Molecular formula | C20H20FN3O4S |
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| Average molar mass | 417.5 g/mol |
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| SMILES | O=C(NOC[C@H](O)CO)c1ccc2cnsc2c1Nc1ccc(C2CC2)cc1F |
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| InChIKey | JKTVFQGPPKJXHP-CQSZACIVSA-N |
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| PubChem CID | 44603268 |
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Chemical & Physical Properties
| XLogP | 3.4 |
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| Topological polar surface area | 132 |
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| Hydrogen bond donors | 4 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 8 |
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| Heavy atoms | 29 |
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| Formal charge | 0 |
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| Complexity | 570 |
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![7-(4-Cyclopropyl-2-fluoro-phenylamino)-benzo[d]isothiazole-6-carboxylic acid ((R)-2,3-dihydroxy-propoxy)-amide molecular structure](/img/chemical/44603268.png)