6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 4-methylbenzene-1-sulfonate
6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 4-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | Y041-5355 |
| Compound Name: | 6-chloro-2-oxo-4-phenyl-2H-1-benzopyran-7-yl 4-methylbenzene-1-sulfonate |
| Molecular Weight: | 426.87 |
| Molecular Formula: | C22 H15 Cl O5 S |
| Smiles: | Cc1ccc(cc1)S(=O)(=O)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2081 |
| logD: | 5.2081 |
| logSw: | -5.6807 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.222 |
| InChI Key: | VBOZVBOFPGLENK-UHFFFAOYSA-N |