2-(4-butoxyphenyl)-4-{[4-(octyloxy)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-butoxyphenyl)-4-{[4-(octyloxy)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(4-butoxyphenyl)-4-{[4-(octyloxy)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 0878-7178 |
| Compound Name: | 2-(4-butoxyphenyl)-4-{[4-(octyloxy)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C28 H35 N O4 |
| Smiles: | CCCCCCCCOc1ccc(/C=C2/C(=O)OC(c3ccc(cc3)OCCCC)=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 8.2004 |
| logD: | 8.2004 |
| logSw: | -5.8391 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.211 |
| InChI Key: | VRQNXTFIYLKSON-UHFFFAOYSA-N |