3-(azepane-1-sulfonyl)-6-fluoro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(azepane-1-sulfonyl)-6-fluoro-2H-1-benzopyran-2-one
3-(azepane-1-sulfonyl)-6-fluoro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | F312-0065 |
| Compound Name: | 3-(azepane-1-sulfonyl)-6-fluoro-2H-1-benzopyran-2-one |
| Molecular Weight: | 325.36 |
| Molecular Formula: | C15 H16 F N O4 S |
| Smiles: | C1CCCN(CC1)S(C1=Cc2cc(ccc2OC1=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5742 |
| logD: | 2.5742 |
| logSw: | -3.0549 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.202 |
| InChI Key: | DPJHXDKDUCLHKA-UHFFFAOYSA-N |