2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-3,4-dibromo-6-methoxyphenol
Chemical Structure Depiction of
2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-3,4-dibromo-6-methoxyphenol
2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-3,4-dibromo-6-methoxyphenol
Compound characteristics
Compound ID: | 8005-6786 |
Compound Name: | 2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-3,4-dibromo-6-methoxyphenol |
Molecular Weight: | 534.22 |
Molecular Formula: | C21 H14 Br2 N2 O3 S |
Smiles: | COc1cc(c(c(/C=N/c2ccc(c(c2)c2nc3ccccc3s2)O)c1O)[Br])[Br] |
Stereo: | ACHIRAL |
logP: | 6.5722 |
logD: | 6.1042 |
logSw: | -5.6832 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.472 |
InChI Key: | KOUVLUKKDHULLA-UHFFFAOYSA-N |