2-(4-chloro-3-nitrophenyl)-4-[(4-ethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-chloro-3-nitrophenyl)-4-[(4-ethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
2-(4-chloro-3-nitrophenyl)-4-[(4-ethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
Compound ID: | 1894-9029 |
Compound Name: | 2-(4-chloro-3-nitrophenyl)-4-[(4-ethoxyphenyl)methylidene]-1,3-oxazol-5(4H)-one |
Molecular Weight: | 372.76 |
Molecular Formula: | C18 H13 Cl N2 O5 |
Smiles: | CCOc1ccc(/C=C2/C(=O)OC(c3ccc(c(c3)[N+]([O-])=O)[Cl])=N2)cc1 |
Stereo: | ACHIRAL |
logP: | 3.8562 |
logD: | 3.8562 |
logSw: | -4.5943 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 70.58 |
InChI Key: | PUGIIPBMNXQDPM-UHFFFAOYSA-N |