5-(azepan-1-yl)-2-[(3-chlorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(azepan-1-yl)-2-[(3-chlorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
5-(azepan-1-yl)-2-[(3-chlorophenoxy)methyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | 6487-0372 |
| Compound Name: | 5-(azepan-1-yl)-2-[(3-chlorophenoxy)methyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 331.8 |
| Molecular Formula: | C17 H18 Cl N3 O2 |
| Smiles: | C1CCCN(CC1)c1c(C#N)nc(COc2cccc(c2)[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 4.5494 |
| logD: | 4.5494 |
| logSw: | -4.5433 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 47.25 |
| InChI Key: | UYJCRCRDSVIYIZ-UHFFFAOYSA-N |