7-hydroxy-1-(2-methoxyethyl)-N-[2-(pyridin-4-yl)ethyl]-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Chemical Structure Depiction of
7-hydroxy-1-(2-methoxyethyl)-N-[2-(pyridin-4-yl)ethyl]-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
7-hydroxy-1-(2-methoxyethyl)-N-[2-(pyridin-4-yl)ethyl]-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Compound characteristics
| Compound ID: | S768-0264 |
| Compound Name: | 7-hydroxy-1-(2-methoxyethyl)-N-[2-(pyridin-4-yl)ethyl]-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C23 H31 N3 O3 |
| Smiles: | COCCN1CCCCCC(c2cc(ccc12)C(NCCc1ccncc1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1711 |
| logD: | 2.1262 |
| logSw: | -2.7617 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.023 |
| InChI Key: | KLNLYNHDTFJBFT-QFIPXVFZSA-N |