2-(4-chloro-3-nitrophenyl)-4-{[3-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-chloro-3-nitrophenyl)-4-{[3-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
2-(4-chloro-3-nitrophenyl)-4-{[3-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2113-0033 |
| Compound Name: | 2-(4-chloro-3-nitrophenyl)-4-{[3-(trifluoromethyl)phenyl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 396.71 |
| Molecular Formula: | C17 H8 Cl F3 N2 O4 |
| Smiles: | C(=C1/C(=O)OC(c2ccc(c(c2)[N+]([O-])=O)[Cl])=N1)\c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.3235 |
| logD: | 4.3235 |
| logSw: | -4.7816 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.456 |
| InChI Key: | UUTVRSOUVHAJHI-UHFFFAOYSA-N |