2-bromo-6-({[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-nitrophenol
Chemical Structure Depiction of
2-bromo-6-({[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-nitrophenol
2-bromo-6-({[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-nitrophenol
Compound characteristics
| Compound ID: | 8005-7070 |
| Compound Name: | 2-bromo-6-({[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-nitrophenol |
| Molecular Weight: | 490.67 |
| Molecular Formula: | C20 H10 Br Cl F N3 O4 |
| Smiles: | C(\c1cc(cc(c1O)[Br])[N+]([O-])=O)=N/c1ccc2c(c1)nc(c1ccc(cc1[Cl])F)o2 |
| Stereo: | ACHIRAL |
| logP: | 6.1549 |
| logD: | 3.0706 |
| logSw: | -6.0312 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.037 |
| InChI Key: | XMLWDJTZWBAMCF-UHFFFAOYSA-N |