N-[2-(azepan-1-yl)ethyl]-2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamide
N-[2-(azepan-1-yl)ethyl]-2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamide
Compound characteristics
| Compound ID: | E613-0274 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-{[5-(2H-1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy}acetamide |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C21 H27 N3 O5 |
| Smiles: | C1CCCN(CC1)CCNC(COCc1cc(c2ccc3c(c2)OCO3)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4174 |
| logD: | 0.6848 |
| logSw: | -2.8753 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.174 |
| InChI Key: | SKFQEFAUHAJZHT-UHFFFAOYSA-N |