2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-4,6-dinitrophenol
Chemical Structure Depiction of
2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-4,6-dinitrophenol
2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-4,6-dinitrophenol
Compound characteristics
| Compound ID: | 8004-0977 |
| Compound Name: | 2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-4,6-dinitrophenol |
| Molecular Weight: | 436.4 |
| Molecular Formula: | C20 H12 N4 O6 S |
| Smiles: | C(/c1cc(cc(c1O)[N+]([O-])=O)[N+]([O-])=O)=N/c1ccc(c(c1)c1nc2ccccc2s1)O |
| Stereo: | ACHIRAL |
| logP: | 5.6031 |
| logD: | 0.7757 |
| logSw: | -5.7282 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 116.304 |
| InChI Key: | CGIXTGWZJJOAEJ-UHFFFAOYSA-N |