4-[(3-bromophenyl)methylidene]-2-(2-chloro-4-methoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(3-bromophenyl)methylidene]-2-(2-chloro-4-methoxyphenyl)-1,3-oxazol-5(4H)-one
4-[(3-bromophenyl)methylidene]-2-(2-chloro-4-methoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0498 |
| Compound Name: | 4-[(3-bromophenyl)methylidene]-2-(2-chloro-4-methoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 392.63 |
| Molecular Formula: | C17 H11 Br Cl N O3 |
| Smiles: | COc1ccc(C2=NC(=C/c3cccc(c3)[Br])\C(=O)O2)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.659 |
| logD: | 4.659 |
| logSw: | -5.0642 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.919 |
| InChI Key: | ITLCDTYNMSXLGC-UHFFFAOYSA-N |