2-(3-methoxyphenyl)-4-{[4-(octyloxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-4-{[4-(octyloxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
2-(3-methoxyphenyl)-4-{[4-(octyloxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0462 |
| Compound Name: | 2-(3-methoxyphenyl)-4-{[4-(octyloxy)anilino]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 422.52 |
| Molecular Formula: | C25 H30 N2 O4 |
| Smiles: | CCCCCCCCOc1ccc(cc1)N/C=C1/C(=O)OC(c2cccc(c2)OC)=N1 |
| Stereo: | ACHIRAL |
| logP: | 6.5486 |
| logD: | 6.5483 |
| logSw: | -5.622 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.938 |
| InChI Key: | PGLWJOSNKCPSBC-UHFFFAOYSA-N |