4-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | 8014-0691 |
| Compound Name: | 4-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 449.48 |
| Molecular Formula: | C24 H19 N O6 S |
| Smiles: | Cc1ccc(cc1)C1=NC(=C\c2ccc(cc2)OS(c2ccc(cc2)OC)(=O)=O)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.6271 |
| logD: | 4.6271 |
| logSw: | -4.5086 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.681 |
| InChI Key: | UOHPHAIJTSHDKD-UHFFFAOYSA-N |