3-(4-bromobenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-bromobenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-one
3-(4-bromobenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-0061 |
| Compound Name: | 3-(4-bromobenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 395.23 |
| Molecular Formula: | C16 H11 Br O5 S |
| Smiles: | COc1ccc2C=C(C(=O)Oc2c1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7159 |
| logD: | 3.7159 |
| logSw: | -4.2059 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.205 |
| InChI Key: | PPAHTMVJDZFXSB-UHFFFAOYSA-N |