4-[(2-bromo-4-methylanilino)methylidene]-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(2-bromo-4-methylanilino)methylidene]-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
4-[(2-bromo-4-methylanilino)methylidene]-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0577 |
| Compound Name: | 4-[(2-bromo-4-methylanilino)methylidene]-2-(naphthalen-1-yl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 407.26 |
| Molecular Formula: | C21 H15 Br N2 O2 |
| Smiles: | Cc1ccc(c(c1)[Br])N\C=C1/C(=O)OC(c2cccc3ccccc23)=N1 |
| Stereo: | ACHIRAL |
| logP: | 4.914 |
| logD: | 4.9138 |
| logSw: | -5.4295 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.007 |
| InChI Key: | JCMUUMGUSGHLAZ-UHFFFAOYSA-N |