3-(3-chlorobenzene-1-sulfonyl)-8-ethoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3-chlorobenzene-1-sulfonyl)-8-ethoxy-2H-1-benzopyran-2-one
3-(3-chlorobenzene-1-sulfonyl)-8-ethoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-1099 |
| Compound Name: | 3-(3-chlorobenzene-1-sulfonyl)-8-ethoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 364.8 |
| Molecular Formula: | C17 H13 Cl O5 S |
| Smiles: | CCOc1cccc2C=C(C(=O)Oc12)S(c1cccc(c1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7031 |
| logD: | 3.7031 |
| logSw: | -4.0793 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.555 |
| InChI Key: | FDYLFTGEKGRUPY-UHFFFAOYSA-N |