2-({[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
Chemical Structure Depiction of
2-({[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
2-({[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
Compound characteristics
| Compound ID: | 8002-0167 |
| Compound Name: | 2-({[3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol |
| Molecular Weight: | 373.37 |
| Molecular Formula: | C21 H15 N3 O4 |
| Smiles: | Cc1ccc2c(c1)oc(c1cccc(c1)/N=C/c1cccc(c1O)[N+]([O-])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.1124 |
| logD: | 3.2324 |
| logSw: | -4.9986 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.736 |
| InChI Key: | BBTQVNUFZQEUBI-UHFFFAOYSA-N |