2-(4-butoxyphenyl)-4-[(3-chloro-4-methoxyanilino)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-butoxyphenyl)-4-[(3-chloro-4-methoxyanilino)methylidene]-1,3-oxazol-5(4H)-one
2-(4-butoxyphenyl)-4-[(3-chloro-4-methoxyanilino)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-1051 |
| Compound Name: | 2-(4-butoxyphenyl)-4-[(3-chloro-4-methoxyanilino)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 400.86 |
| Molecular Formula: | C21 H21 Cl N2 O4 |
| Smiles: | CCCCOc1ccc(cc1)C1=NC(=C/Nc2ccc(c(c2)[Cl])OC)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.8643 |
| logD: | 4.861 |
| logSw: | -5.0765 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.025 |
| InChI Key: | GGFOBRJUXMZNCN-UHFFFAOYSA-N |