2-(3-bromo-4-methoxyphenyl)-4-[(3-methylthiophen-2-yl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3-bromo-4-methoxyphenyl)-4-[(3-methylthiophen-2-yl)methylidene]-1,3-oxazol-5(4H)-one
2-(3-bromo-4-methoxyphenyl)-4-[(3-methylthiophen-2-yl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-3083 |
| Compound Name: | 2-(3-bromo-4-methoxyphenyl)-4-[(3-methylthiophen-2-yl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 378.24 |
| Molecular Formula: | C16 H12 Br N O3 S |
| Smiles: | Cc1ccsc1/C=C1/C(=O)OC(c2ccc(c(c2)[Br])OC)=N1 |
| Stereo: | ACHIRAL |
| logP: | 4.1073 |
| logD: | 4.1073 |
| logSw: | -4.4956 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.024 |
| InChI Key: | NQIMQXQLLORATD-UHFFFAOYSA-N |