N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methylpiperidin-1-yl)methyl]azepane-1-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methylpiperidin-1-yl)methyl]azepane-1-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methylpiperidin-1-yl)methyl]azepane-1-carboxamide
Compound characteristics
| Compound ID: | S534-0591 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4-methylpiperidin-1-yl)methyl]azepane-1-carboxamide |
| Molecular Weight: | 387.52 |
| Molecular Formula: | C22 H33 N3 O3 |
| Smiles: | CC1CCN(CC1)CC1CCCCCN1C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8875 |
| logD: | 0.5496 |
| logSw: | -3.2629 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.241 |
| InChI Key: | IWOMLYZIJSNUSH-LJQANCHMSA-N |