7-hydroxy-1-(2-methoxyethyl)-N-methyl-N-[(pyridin-3-yl)methyl]-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Chemical Structure Depiction of
7-hydroxy-1-(2-methoxyethyl)-N-methyl-N-[(pyridin-3-yl)methyl]-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
7-hydroxy-1-(2-methoxyethyl)-N-methyl-N-[(pyridin-3-yl)methyl]-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Compound characteristics
| Compound ID: | S768-0277 |
| Compound Name: | 7-hydroxy-1-(2-methoxyethyl)-N-methyl-N-[(pyridin-3-yl)methyl]-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C23 H31 N3 O3 |
| Smiles: | CN(Cc1cccnc1)C(c1ccc2c(c1)C(CCCCCN2CCOC)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4201 |
| logD: | 2.42 |
| logSw: | -2.6885 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.009 |
| InChI Key: | ADENJQARRVQZNP-QFIPXVFZSA-N |