2-(4-methylphenyl)-4-{[4-(trifluoromethoxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-methylphenyl)-4-{[4-(trifluoromethoxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
2-(4-methylphenyl)-4-{[4-(trifluoromethoxy)anilino]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0035 |
| Compound Name: | 2-(4-methylphenyl)-4-{[4-(trifluoromethoxy)anilino]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 362.31 |
| Molecular Formula: | C18 H13 F3 N2 O3 |
| Smiles: | Cc1ccc(cc1)C1=NC(=C/Nc2ccc(cc2)OC(F)(F)F)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.6566 |
| logD: | 4.6564 |
| logSw: | -4.4485 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.913 |
| InChI Key: | QJPOTDKOFNZZAJ-UHFFFAOYSA-N |