2-(4-chlorophenyl)-4-{[4-(octyloxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-4-{[4-(octyloxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
2-(4-chlorophenyl)-4-{[4-(octyloxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2113-0051 |
| Compound Name: | 2-(4-chlorophenyl)-4-{[4-(octyloxy)anilino]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 426.94 |
| Molecular Formula: | C24 H27 Cl N2 O3 |
| Smiles: | CCCCCCCCOc1ccc(cc1)N/C=C1/C(=O)OC(c2ccc(cc2)[Cl])=N1 |
| Stereo: | ACHIRAL |
| logP: | 7.107 |
| logD: | 7.1067 |
| logSw: | -6.4382 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.394 |
| InChI Key: | IYVGOXPHYUNJJL-UHFFFAOYSA-N |