2-(4-methyl-3-nitrophenyl)-4-{[3-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-methyl-3-nitrophenyl)-4-{[3-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(4-methyl-3-nitrophenyl)-4-{[3-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-2534 |
| Compound Name: | 2-(4-methyl-3-nitrophenyl)-4-{[3-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 376.29 |
| Molecular Formula: | C18 H11 F3 N2 O4 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C1=NC(=C/c2cccc(c2)C(F)(F)F)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.4565 |
| logD: | 4.4565 |
| logSw: | -4.6089 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.456 |
| InChI Key: | ZFQLUSQIVSMABP-UHFFFAOYSA-N |