2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
Chemical Structure Depiction of
2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
Compound characteristics
| Compound ID: | 8005-7343 |
| Compound Name: | 2-({[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol |
| Molecular Weight: | 453.9 |
| Molecular Formula: | C22 H16 Cl N3 O4 S |
| Smiles: | Cc1c(/C=N/c2ccc(c(c2)c2nc3ccccc3s2)O)c(c(c(C)c1[Cl])[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 6.9823 |
| logD: | 5.2023 |
| logSw: | -6.1675 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.622 |
| InChI Key: | XHSJJJDHZXMBJZ-UHFFFAOYSA-N |