N-[2-(azepan-1-yl)ethyl]-3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazole-5-carboxamide
N-[2-(azepan-1-yl)ethyl]-3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | L471-2212 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-3-[4-(dimethylamino)phenyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 357.45 |
| Molecular Formula: | C19 H27 N5 O2 |
| Smiles: | CN(C)c1ccc(cc1)c1nc(C(NCCN2CCCCCC2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.0231 |
| logD: | 1.4251 |
| logSw: | -3.2104 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.289 |
| InChI Key: | UPXSDHCBCNIPMJ-UHFFFAOYSA-N |