5-(azepan-1-yl)-2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(azepan-1-yl)-2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-(azepan-1-yl)-2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D561-1005 |
| Compound Name: | 5-(azepan-1-yl)-2-{5-[(3,4-dimethylphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C23 H25 N3 O3 |
| Smiles: | Cc1ccc(cc1C)OCc1ccc(c2nc(C#N)c(N3CCCCCC3)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.8219 |
| logD: | 5.8219 |
| logSw: | -5.4371 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.155 |
| InChI Key: | WFIMDTAURYAVBU-UHFFFAOYSA-N |