1-[1-hydroxy-2-(4-methoxy-3-nitrophenyl)-4-methyl-1H-imidazol-5-yl]ethan-1-one
Chemical Structure Depiction of
1-[1-hydroxy-2-(4-methoxy-3-nitrophenyl)-4-methyl-1H-imidazol-5-yl]ethan-1-one
1-[1-hydroxy-2-(4-methoxy-3-nitrophenyl)-4-methyl-1H-imidazol-5-yl]ethan-1-one
Compound characteristics
| Compound ID: | 8013-2819 |
| Compound Name: | 1-[1-hydroxy-2-(4-methoxy-3-nitrophenyl)-4-methyl-1H-imidazol-5-yl]ethan-1-one |
| Molecular Weight: | 291.26 |
| Molecular Formula: | C13 H13 N3 O5 |
| Smiles: | CC(c1c(C)nc(c2ccc(c(c2)[N+]([O-])=O)OC)n1O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1945 |
| logD: | -1.2276 |
| logSw: | -1.9769 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.911 |
| InChI Key: | OEZZLLUXYZWHBQ-UHFFFAOYSA-N |