4-{[4-(octyloxy)phenyl]methylidene}-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-{[4-(octyloxy)phenyl]methylidene}-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one
4-{[4-(octyloxy)phenyl]methylidene}-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K075-1922 |
| Compound Name: | 4-{[4-(octyloxy)phenyl]methylidene}-2-(thiophen-2-yl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C22 H25 N O3 S |
| Smiles: | CCCCCCCCOc1ccc(/C=C2/C(=O)OC(c3cccs3)=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.6051 |
| logD: | 6.6051 |
| logSw: | -5.6818 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.812 |
| InChI Key: | PUQZAVRALFPSFJ-UHFFFAOYSA-N |