N-[(3,5-difluorophenyl)methyl]-7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Chemical Structure Depiction of
N-[(3,5-difluorophenyl)methyl]-7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
N-[(3,5-difluorophenyl)methyl]-7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide
Compound characteristics
| Compound ID: | S768-0257 |
| Compound Name: | N-[(3,5-difluorophenyl)methyl]-7-hydroxy-1-(2-methoxyethyl)-2,3,4,5,6,7-hexahydro-1H-1-benzazonine-9-carboxamide |
| Molecular Weight: | 418.48 |
| Molecular Formula: | C23 H28 F2 N2 O3 |
| Smiles: | COCCN1CCCCCC(c2cc(ccc12)C(NCc1cc(cc(c1)F)F)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1271 |
| logD: | 4.1268 |
| logSw: | -4.1996 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.754 |
| InChI Key: | SHSNJOGMMICIDX-QFIPXVFZSA-N |