4-bromo-2-chloro-6-({[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]imino}methyl)phenol
Chemical Structure Depiction of
4-bromo-2-chloro-6-({[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]imino}methyl)phenol
4-bromo-2-chloro-6-({[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]imino}methyl)phenol
Compound characteristics
Compound ID: | 8002-3998 |
Compound Name: | 4-bromo-2-chloro-6-({[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]imino}methyl)phenol |
Molecular Weight: | 428.67 |
Molecular Formula: | C19 H11 Br Cl N3 O2 |
Smiles: | C(\c1cc(cc(c1O)[Cl])[Br])=N/c1ccc2c(c1)nc(c1ccncc1)o2 |
Stereo: | ACHIRAL |
logP: | 5.146 |
logD: | 4.6012 |
logSw: | -5.2732 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.083 |
InChI Key: | KJQGDAZHOAUSFX-UHFFFAOYSA-N |