4-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methylbenzene-1-sulfonate
4-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | 8007-4796 |
| Compound Name: | 4-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methylbenzene-1-sulfonate |
| Molecular Weight: | 453.9 |
| Molecular Formula: | C23 H16 Cl N O5 S |
| Smiles: | Cc1ccc(cc1)S(=O)(=O)Oc1ccc(/C=C2/C(=O)OC(c3ccc(cc3)[Cl])=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2394 |
| logD: | 5.2394 |
| logSw: | -5.9458 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.137 |
| InChI Key: | OXEBKKYDYXBNHR-UHFFFAOYSA-N |