2-({[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-nitrophenol
Chemical Structure Depiction of
2-({[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-nitrophenol
2-({[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-nitrophenol
Compound characteristics
| Compound ID: | 8001-7700 |
| Compound Name: | 2-({[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-nitrophenol |
| Molecular Weight: | 387.39 |
| Molecular Formula: | C22 H17 N3 O4 |
| Smiles: | Cc1ccc(cc1C)c1nc2cc(ccc2o1)/N=C/c1cc(ccc1O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6126 |
| logD: | 3.7612 |
| logSw: | -5.3621 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.106 |
| InChI Key: | YEELCKFZNMFMRJ-UHFFFAOYSA-N |