2-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate
2-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate
Compound characteristics
| Compound ID: | 8008-3622 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate |
| Molecular Weight: | 439.87 |
| Molecular Formula: | C22 H14 Cl N O5 S |
| Smiles: | C(=C1/C(=O)OC(c2ccc(cc2)[Cl])=N1)\c1ccccc1OS(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6292 |
| logD: | 4.6292 |
| logSw: | -5.1997 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.224 |
| InChI Key: | TZILHCLRAVHTPN-UHFFFAOYSA-N |