N-benzyl-N-[2-(dimethylamino)ethyl]-7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Chemical Structure Depiction of
N-benzyl-N-[2-(dimethylamino)ethyl]-7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
N-benzyl-N-[2-(dimethylamino)ethyl]-7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Compound characteristics
| Compound ID: | S768-0242 |
| Compound Name: | N-benzyl-N-[2-(dimethylamino)ethyl]-7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide |
| Molecular Weight: | 453.63 |
| Molecular Formula: | C27 H39 N3 O3 |
| Smiles: | CN(C)CCN(Cc1ccccc1)C(c1ccc2c(c1)C(CCCCCN2CCOC)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4278 |
| logD: | 3.092 |
| logSw: | -3.678 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.396 |
| InChI Key: | AGVRUXJNTBBVJN-SANMLTNESA-N |