N-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
N-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
N-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-1877 |
| Compound Name: | N-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C23 H28 N2 O4 |
| Smiles: | C1CCN(CC1)CCOc1ccc(cc1)NC(c1ccc2c(c1)OCCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2813 |
| logD: | 1.9702 |
| logSw: | -3.5051 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.612 |
| InChI Key: | OXTJXICSKZLSPV-UHFFFAOYSA-N |