2-({[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-6-methoxy-4-nitrophenol
Chemical Structure Depiction of
2-({[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-6-methoxy-4-nitrophenol
2-({[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-6-methoxy-4-nitrophenol
Compound characteristics
| Compound ID: | 8005-7720 |
| Compound Name: | 2-({[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-6-methoxy-4-nitrophenol |
| Molecular Weight: | 458.26 |
| Molecular Formula: | C21 H13 Cl2 N3 O5 |
| Smiles: | COc1cc(cc(/C=N/c2ccc3c(c2)nc(c2cc(ccc2[Cl])[Cl])o3)c1O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5397 |
| logD: | 3.3728 |
| logSw: | -5.7824 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.667 |
| InChI Key: | JKZQNSWDCIXJDQ-UHFFFAOYSA-N |