4-{[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate
Chemical Structure Depiction of
4-{[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate
4-{[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate
Compound characteristics
| Compound ID: | Y508-0784 |
| Compound Name: | 4-{[2-(4-bromophenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}-2-chloro-6-methoxyphenyl acetate |
| Molecular Weight: | 450.67 |
| Molecular Formula: | C19 H13 Br Cl N O5 |
| Smiles: | CC(=O)Oc1c(cc(\C=C2/C(=O)OC(c3ccc(cc3)[Br])=N2)cc1[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 4.642 |
| logD: | 4.642 |
| logSw: | -5.0755 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.93 |
| InChI Key: | RPGZKYRAJJVNRI-UHFFFAOYSA-N |