2-{5-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl}benzonitrile
Chemical Structure Depiction of
2-{5-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl}benzonitrile
2-{5-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl}benzonitrile
Compound characteristics
| Compound ID: | 8017-9251 |
| Compound Name: | 2-{5-[2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl}benzonitrile |
| Molecular Weight: | 321.29 |
| Molecular Formula: | C17 H11 N3 O4 |
| Smiles: | Cc1c(c(/C=C/c2ccc(c3ccccc3C#N)o2)on1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6452 |
| logD: | 3.6452 |
| logSw: | -4.0969 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 79.16 |
| InChI Key: | IREAEIFTBGZXCU-UHFFFAOYSA-N |