2-[2-(4-chlorophenyl)ethenyl]-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-[2-(4-chlorophenyl)ethenyl]-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-[2-(4-chlorophenyl)ethenyl]-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-1613 |
| Compound Name: | 2-[2-(4-chlorophenyl)ethenyl]-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 355.84 |
| Molecular Formula: | C19 H14 Cl N O2 S |
| Smiles: | CSc1ccc(\C=C2/C(=O)OC(/C=C/c3ccc(cc3)[Cl])=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2874 |
| logD: | 5.2874 |
| logSw: | -6.1576 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 30.5216 |
| InChI Key: | YPBHYCNTIQBRQA-UHFFFAOYSA-N |