4-({[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-2,6-dinitrobenzene-1,3-diol
Chemical Structure Depiction of
4-({[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-2,6-dinitrobenzene-1,3-diol
4-({[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-2,6-dinitrobenzene-1,3-diol
Compound characteristics
| Compound ID: | 8005-6293 |
| Compound Name: | 4-({[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-2,6-dinitrobenzene-1,3-diol |
| Molecular Weight: | 489.23 |
| Molecular Formula: | C20 H10 Cl2 N4 O7 |
| Smiles: | C(\c1cc(c(c(c1O)[N+]([O-])=O)O)[N+]([O-])=O)=N/c1ccc2c(c1)nc(c1cccc(c1[Cl])[Cl])o2 |
| Stereo: | ACHIRAL |
| logP: | 5.9052 |
| logD: | 0.84 |
| logSw: | -5.8636 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 121.995 |
| InChI Key: | KQCGJSGAOXAYJL-UHFFFAOYSA-N |