2-(5-bromo-2-methoxyphenyl)-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(5-bromo-2-methoxyphenyl)-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(5-bromo-2-methoxyphenyl)-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0719 |
| Compound Name: | 2-(5-bromo-2-methoxyphenyl)-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 404.28 |
| Molecular Formula: | C18 H14 Br N O3 S |
| Smiles: | COc1ccc(cc1C1=NC(=C/c2ccc(cc2)SC)\C(=O)O1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.6566 |
| logD: | 4.6566 |
| logSw: | -4.6693 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.006 |
| InChI Key: | OFGPDLOFJXNZHI-UHFFFAOYSA-N |