3-(benzenesulfonyl)-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-6-methoxy-2H-1-benzopyran-2-one
3-(benzenesulfonyl)-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-0073 |
| Compound Name: | 3-(benzenesulfonyl)-6-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 316.33 |
| Molecular Formula: | C16 H12 O5 S |
| Smiles: | COc1ccc2c(C=C(C(=O)O2)S(c2ccccc2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.5977 |
| logD: | 2.5977 |
| logSw: | -3.0412 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.205 |
| InChI Key: | IIAWACMGWCKHRF-UHFFFAOYSA-N |