3,4-dibromo-6-ethoxy-2-{[(2-phenyl-1,3-benzoxazol-5-yl)imino]methyl}phenol
Chemical Structure Depiction of
3,4-dibromo-6-ethoxy-2-{[(2-phenyl-1,3-benzoxazol-5-yl)imino]methyl}phenol
3,4-dibromo-6-ethoxy-2-{[(2-phenyl-1,3-benzoxazol-5-yl)imino]methyl}phenol
Compound characteristics
| Compound ID: | 0957-0001 |
| Compound Name: | 3,4-dibromo-6-ethoxy-2-{[(2-phenyl-1,3-benzoxazol-5-yl)imino]methyl}phenol |
| Molecular Weight: | 516.19 |
| Molecular Formula: | C22 H16 Br2 N2 O3 |
| Smiles: | CCOc1cc(c(c(/C=N/c2ccc3c(c2)nc(c2ccccc2)o3)c1O)[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.3921 |
| logD: | 6.0879 |
| logSw: | -5.6453 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.866 |
| InChI Key: | LCHAJVVVGHCTCX-UHFFFAOYSA-N |