4-{2-[4-(methylsulfanyl)phenyl]-4H-1-benzopyran-4-ylidene}-2-phenyl-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-{2-[4-(methylsulfanyl)phenyl]-4H-1-benzopyran-4-ylidene}-2-phenyl-1,3-oxazol-5(4H)-one
4-{2-[4-(methylsulfanyl)phenyl]-4H-1-benzopyran-4-ylidene}-2-phenyl-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 7612-0016 |
| Compound Name: | 4-{2-[4-(methylsulfanyl)phenyl]-4H-1-benzopyran-4-ylidene}-2-phenyl-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C25 H17 N O3 S |
| Smiles: | CSc1ccc(cc1)C1=C\C(=C2/C(=O)OC(c3ccccc3)=N2)c2ccccc2O1 |
| Stereo: | ACHIRAL |
| logP: | 5.975 |
| logD: | 5.975 |
| logSw: | -5.6822 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.095 |
| InChI Key: | WCZFFJLROPLUQX-UHFFFAOYSA-N |