3-{[2-(2,5-dichlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzoate
Chemical Structure Depiction of
3-{[2-(2,5-dichlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzoate
3-{[2-(2,5-dichlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzoate
Compound characteristics
| Compound ID: | 8011-6205 |
| Compound Name: | 3-{[2-(2,5-dichlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzoate |
| Molecular Weight: | 438.27 |
| Molecular Formula: | C23 H13 Cl2 N O4 |
| Smiles: | C(=C1/C(=O)OC(c2cc(ccc2[Cl])[Cl])=N1)/c1cccc(c1)OC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3434 |
| logD: | 5.3434 |
| logSw: | -5.9313 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.753 |
| InChI Key: | ZOSMDNNZZKSTQY-UHFFFAOYSA-N |