3-(benzenesulfonyl)-6-bromo-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-6-bromo-8-methoxy-2H-1-benzopyran-2-one
3-(benzenesulfonyl)-6-bromo-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-1049 |
| Compound Name: | 3-(benzenesulfonyl)-6-bromo-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 395.23 |
| Molecular Formula: | C16 H11 Br O5 S |
| Smiles: | COc1cc(cc2C=C(C(=O)Oc12)S(c1ccccc1)(=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.4878 |
| logD: | 3.4878 |
| logSw: | -3.8411 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.976 |
| InChI Key: | GDRCHQWVOAXQPV-UHFFFAOYSA-N |