4-(anilinomethylidene)-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-(anilinomethylidene)-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
4-(anilinomethylidene)-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-1062 |
| Compound Name: | 4-(anilinomethylidene)-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 309.28 |
| Molecular Formula: | C16 H11 N3 O4 |
| Smiles: | C(=C1/C(=O)OC(c2ccc(cc2)[N+]([O-])=O)=N1)/Nc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.776 |
| logD: | 2.7759 |
| logSw: | -3.4129 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.358 |
| InChI Key: | FBPKMDAIFGHEBE-UHFFFAOYSA-N |