5-(azepan-1-yl)-2-{5-[(4-chlorophenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(azepan-1-yl)-2-{5-[(4-chlorophenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
5-(azepan-1-yl)-2-{5-[(4-chlorophenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D301-0144 |
| Compound Name: | 5-(azepan-1-yl)-2-{5-[(4-chlorophenoxy)methyl]furan-2-yl}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 397.86 |
| Molecular Formula: | C21 H20 Cl N3 O3 |
| Smiles: | C1CCCN(CC1)c1c(C#N)nc(c2ccc(COc3ccc(cc3)[Cl])o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.3802 |
| logD: | 5.3802 |
| logSw: | -6.0486 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.155 |
| InChI Key: | VJHAHPJHIMKPSM-UHFFFAOYSA-N |