2,4-dibromo-6-({[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl)phenol
Chemical Structure Depiction of
2,4-dibromo-6-({[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl)phenol
2,4-dibromo-6-({[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl)phenol
Compound characteristics
Compound ID: | 0808-0043 |
Compound Name: | 2,4-dibromo-6-({[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl)phenol |
Molecular Weight: | 516.19 |
Molecular Formula: | C22 H16 Br2 N2 O3 |
Smiles: | CCOc1ccc(cc1)c1nc2cc(ccc2o1)/N=C/c1cc(cc(c1O)[Br])[Br] |
Stereo: | ACHIRAL |
logP: | 6.6096 |
logD: | 6.0431 |
logSw: | -5.683 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.779 |
InChI Key: | QDAYYTQMTDFZOG-UHFFFAOYSA-N |