8-methyl-N-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Chemical Structure Depiction of
8-methyl-N-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
8-methyl-N-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
Compound characteristics
| Compound ID: | J031-1927 |
| Compound Name: | 8-methyl-N-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide |
| Molecular Weight: | 410.51 |
| Molecular Formula: | C24 H30 N2 O4 |
| Smiles: | Cc1cc2c(cc1C(Nc1ccc(cc1)OCCN1CCCCC1)=O)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.6061 |
| logD: | 2.295 |
| logSw: | -3.6875 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.612 |
| InChI Key: | GAYVTUAJUMCQBB-UHFFFAOYSA-N |