4-[6-(4-methoxy-3,5-dimethylphenyl)-1,3-benzoxazol-2-yl]benzonitrile
Chemical Structure Depiction of
4-[6-(4-methoxy-3,5-dimethylphenyl)-1,3-benzoxazol-2-yl]benzonitrile
4-[6-(4-methoxy-3,5-dimethylphenyl)-1,3-benzoxazol-2-yl]benzonitrile
Compound characteristics
| Compound ID: | V007-0569 |
| Compound Name: | 4-[6-(4-methoxy-3,5-dimethylphenyl)-1,3-benzoxazol-2-yl]benzonitrile |
| Molecular Weight: | 354.41 |
| Molecular Formula: | C23 H18 N2 O2 |
| Smiles: | Cc1cc(cc(C)c1OC)c1ccc2c(c1)oc(c1ccc(C#N)cc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.8443 |
| logD: | 5.8443 |
| logSw: | -5.6348 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.55 |
| InChI Key: | BVOIFSVFWAVUGG-UHFFFAOYSA-N |