5-(azepan-1-yl)-2-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(azepan-1-yl)-2-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-(azepan-1-yl)-2-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D301-0194 |
| Compound Name: | 5-(azepan-1-yl)-2-{5-[(4-methoxyphenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C22 H23 N3 O4 |
| Smiles: | COc1ccc(cc1)OCc1ccc(c2nc(C#N)c(N3CCCCCC3)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.7679 |
| logD: | 4.7679 |
| logSw: | -4.4808 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.698 |
| InChI Key: | SKCGZNSUOIMQGF-UHFFFAOYSA-N |