2-(4-bromophenyl)-4-[(2-methyl-5-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-bromophenyl)-4-[(2-methyl-5-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
2-(4-bromophenyl)-4-[(2-methyl-5-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2084-9966 |
| Compound Name: | 2-(4-bromophenyl)-4-[(2-methyl-5-nitroanilino)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 402.2 |
| Molecular Formula: | C17 H12 Br N3 O4 |
| Smiles: | Cc1ccc(cc1N/C=C1/C(=O)OC(c2ccc(cc2)[Br])=N1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0425 |
| logD: | 4.0278 |
| logSw: | -4.2132 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.66 |
| InChI Key: | QDIOBJBJCQSWQK-UHFFFAOYSA-N |