2-(3-{2-[4-(methylsulfanyl)phenyl]ethenyl}-1,2,4-oxadiazol-5-yl)phenyl acetate
Chemical Structure Depiction of
2-(3-{2-[4-(methylsulfanyl)phenyl]ethenyl}-1,2,4-oxadiazol-5-yl)phenyl acetate
2-(3-{2-[4-(methylsulfanyl)phenyl]ethenyl}-1,2,4-oxadiazol-5-yl)phenyl acetate
Compound characteristics
| Compound ID: | 8401-0057 |
| Compound Name: | 2-(3-{2-[4-(methylsulfanyl)phenyl]ethenyl}-1,2,4-oxadiazol-5-yl)phenyl acetate |
| Molecular Weight: | 352.41 |
| Molecular Formula: | C19 H16 N2 O3 S |
| Smiles: | CC(=O)Oc1ccccc1c1nc(/C=C/c2ccc(cc2)SC)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.495 |
| logD: | 4.495 |
| logSw: | -4.621 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.472 |
| InChI Key: | IBZLBNSGNIXZMB-UHFFFAOYSA-N |