2-(2-bromophenyl)-4-[(4-chloro-3-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-bromophenyl)-4-[(4-chloro-3-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
2-(2-bromophenyl)-4-[(4-chloro-3-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 1989-9513 |
| Compound Name: | 2-(2-bromophenyl)-4-[(4-chloro-3-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 422.62 |
| Molecular Formula: | C16 H9 Br Cl N3 O4 |
| Smiles: | C(=C1/C(=O)OC(c2ccccc2[Br])=N1)\Nc1ccc(c(c1)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4692 |
| logD: | 3.1176 |
| logSw: | -4.0309 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.057 |
| InChI Key: | ZZDPTFYHAOHQNU-UHFFFAOYSA-N |