2-bromo-6-({[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-methylphenol
Chemical Structure Depiction of
2-bromo-6-({[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-methylphenol
2-bromo-6-({[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-methylphenol
Compound characteristics
Compound ID: | 8004-4782 |
Compound Name: | 2-bromo-6-({[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-methylphenol |
Molecular Weight: | 425.26 |
Molecular Formula: | C21 H14 Br F N2 O2 |
Smiles: | Cc1cc(/C=N/c2ccc3c(c2)nc(c2cccc(c2)F)o3)c(c(c1)[Br])O |
Stereo: | ACHIRAL |
logP: | 5.784 |
logD: | 5.606 |
logSw: | -5.5906 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.655 |
InChI Key: | TZSLCILXKHLQFZ-UHFFFAOYSA-N |