2-(2-chloro-4-nitrophenyl)-4-[(2,4-dipropoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-chloro-4-nitrophenyl)-4-[(2,4-dipropoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(2-chloro-4-nitrophenyl)-4-[(2,4-dipropoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | Y500-1210 |
| Compound Name: | 2-(2-chloro-4-nitrophenyl)-4-[(2,4-dipropoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 444.87 |
| Molecular Formula: | C22 H21 Cl N2 O6 |
| Smiles: | CCCOc1ccc(\C=C2/C(=O)OC(c3ccc(cc3[Cl])[N+]([O-])=O)=N2)c(c1)OCCC |
| Stereo: | ACHIRAL |
| logP: | 5.8686 |
| logD: | 5.8686 |
| logSw: | -6.1162 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.679 |
| InChI Key: | YYBYQQBRDKSIQE-UHFFFAOYSA-N |