2-methoxy-4-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate
Chemical Structure Depiction of
2-methoxy-4-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate
2-methoxy-4-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate
Compound characteristics
| Compound ID: | 8014-0683 |
| Compound Name: | 2-methoxy-4-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate |
| Molecular Weight: | 449.48 |
| Molecular Formula: | C24 H19 N O6 S |
| Smiles: | Cc1ccc(cc1)C1=NC(=C\c2ccc(c(c2)OC)OS(c2ccccc2)(=O)=O)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.1708 |
| logD: | 4.1708 |
| logSw: | -4.4144 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.854 |
| InChI Key: | BCLHFTLNPGXTTF-UHFFFAOYSA-N |