4-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methylbenzoate
Chemical Structure Depiction of
4-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methylbenzoate
4-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methylbenzoate
Compound characteristics
| Compound ID: | 8009-8623 |
| Compound Name: | 4-{[2-(4-chlorophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 4-methylbenzoate |
| Molecular Weight: | 417.85 |
| Molecular Formula: | C24 H16 Cl N O4 |
| Smiles: | Cc1ccc(cc1)C(=O)Oc1ccc(/C=C2/C(=O)OC(c3ccc(cc3)[Cl])=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4155 |
| logD: | 5.4155 |
| logSw: | -6.2518 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.753 |
| InChI Key: | ICYWALCIQPPSRO-UHFFFAOYSA-N |