7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-5-yl methanesulfonate
Chemical Structure Depiction of
7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-5-yl methanesulfonate
7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-5-yl methanesulfonate
Compound characteristics
| Compound ID: | Y041-5359 |
| Compound Name: | 7-methyl-2-oxo-4-phenyl-2H-1-benzopyran-5-yl methanesulfonate |
| Molecular Weight: | 330.36 |
| Molecular Formula: | C17 H14 O5 S |
| Smiles: | Cc1cc2c(C(=CC(=O)O2)c2ccccc2)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8605 |
| logD: | 2.8605 |
| logSw: | -3.3514 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.61 |
| InChI Key: | SIZUTTYVOUKKTP-UHFFFAOYSA-N |