3-(4-fluoro-3-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-fluoro-3-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-one
3-(4-fluoro-3-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-1107 |
| Compound Name: | 3-(4-fluoro-3-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 318.32 |
| Molecular Formula: | C16 H11 F O4 S |
| Smiles: | Cc1cc(ccc1F)S(C1=Cc2ccccc2OC1=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1377 |
| logD: | 3.1377 |
| logSw: | -3.2829 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.661 |
| InChI Key: | UKQFZNXAGGOCLQ-UHFFFAOYSA-N |