5-bromo-2-methoxy-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenol
Chemical Structure Depiction of
5-bromo-2-methoxy-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenol
5-bromo-2-methoxy-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenol
Compound characteristics
| Compound ID: | 8018-1220 |
| Compound Name: | 5-bromo-2-methoxy-4-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenol |
| Molecular Weight: | 355.14 |
| Molecular Formula: | C13 H11 Br N2 O5 |
| Smiles: | Cc1c(c(/C=C/c2cc(c(cc2[Br])O)OC)on1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9581 |
| logD: | 2.9296 |
| logSw: | -3.034 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.712 |
| InChI Key: | FKKXNIFEHSAGIZ-UHFFFAOYSA-N |