2-({[2-chloro-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-ethoxy-4-nitrophenol
Chemical Structure Depiction of
2-({[2-chloro-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-ethoxy-4-nitrophenol
2-({[2-chloro-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-ethoxy-4-nitrophenol
Compound characteristics
| Compound ID: | 0960-0025 |
| Compound Name: | 2-({[2-chloro-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-ethoxy-4-nitrophenol |
| Molecular Weight: | 451.87 |
| Molecular Formula: | C23 H18 Cl N3 O5 |
| Smiles: | CCOc1cc(cc(/C=N/c2cc(ccc2[Cl])c2nc3cc(C)ccc3o2)c1O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8249 |
| logD: | 3.9365 |
| logSw: | -5.6467 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.549 |
| InChI Key: | NALGWGWJWXRGIY-UHFFFAOYSA-N |