N-(2,5-dimethoxyphenyl)-7-hydroxy-1-methyl-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-7-hydroxy-1-methyl-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
N-(2,5-dimethoxyphenyl)-7-hydroxy-1-methyl-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Compound characteristics
| Compound ID: | S768-0043 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-7-hydroxy-1-methyl-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide |
| Molecular Weight: | 384.47 |
| Molecular Formula: | C22 H28 N2 O4 |
| Smiles: | CN1CCCCCC(c2cc(ccc12)C(Nc1cc(ccc1OC)OC)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3574 |
| logD: | 3.269 |
| logSw: | -3.5516 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.302 |
| InChI Key: | YTFIWEFPTUOARD-FQEVSTJZSA-N |