2-(4-chloro-3-nitrophenyl)-4-[(2,5-dimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-chloro-3-nitrophenyl)-4-[(2,5-dimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(4-chloro-3-nitrophenyl)-4-[(2,5-dimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2125-0581 |
| Compound Name: | 2-(4-chloro-3-nitrophenyl)-4-[(2,5-dimethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 388.76 |
| Molecular Formula: | C18 H13 Cl N2 O6 |
| Smiles: | COc1ccc(c(\C=C2/C(=O)OC(c3ccc(c(c3)[N+]([O-])=O)[Cl])=N2)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6714 |
| logD: | 3.6714 |
| logSw: | -4.3743 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.63 |
| InChI Key: | LHCLKCKXBJJNRD-UHFFFAOYSA-N |