4-{[3-(benzyloxy)phenyl]methylidene}-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-{[3-(benzyloxy)phenyl]methylidene}-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5(4H)-one
4-{[3-(benzyloxy)phenyl]methylidene}-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8007-0520 |
| Compound Name: | 4-{[3-(benzyloxy)phenyl]methylidene}-2-(4-chloro-3-nitrophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 434.83 |
| Molecular Formula: | C23 H15 Cl N2 O5 |
| Smiles: | C(c1ccccc1)Oc1cccc(/C=C2/C(=O)OC(c3ccc(c(c3)[N+]([O-])=O)[Cl])=N2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8762 |
| logD: | 4.8762 |
| logSw: | -5.2715 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.684 |
| InChI Key: | VVRGLDDAAUKFJT-UHFFFAOYSA-N |