2-({[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-methyl-6-nitrophenol
Chemical Structure Depiction of
2-({[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-methyl-6-nitrophenol
2-({[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-methyl-6-nitrophenol
Compound characteristics
| Compound ID: | 8002-1054 |
| Compound Name: | 2-({[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-4-methyl-6-nitrophenol |
| Molecular Weight: | 403.39 |
| Molecular Formula: | C22 H17 N3 O5 |
| Smiles: | Cc1cc(/C=N/c2ccc3c(c2)nc(c2ccc(cc2)OC)o3)c(c(c1)[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 5.2383 |
| logD: | 3.7758 |
| logSw: | -5.0552 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.28 |
| InChI Key: | YCKUZSPYIRSSNU-UHFFFAOYSA-N |