4-{[3-(trifluoromethyl)anilino]methylidene}-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-{[3-(trifluoromethyl)anilino]methylidene}-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-{[3-(trifluoromethyl)anilino]methylidene}-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0264 |
| Compound Name: | 4-{[3-(trifluoromethyl)anilino]methylidene}-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 422.36 |
| Molecular Formula: | C20 H17 F3 N2 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)C1=NC(=C/Nc2cccc(c2)C(F)(F)F)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.5966 |
| logD: | 3.5914 |
| logSw: | -3.9776 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.954 |
| InChI Key: | HULWDYWEJPEAQX-UHFFFAOYSA-N |