rel-(5R,6S)-5-(4-acetyl-1,4-diazepane-1-carbonyl)-1-(2-methoxyethyl)-6-(4-methylphenyl)piperidin-2-one
Chemical Structure Depiction of
rel-(5R,6S)-5-(4-acetyl-1,4-diazepane-1-carbonyl)-1-(2-methoxyethyl)-6-(4-methylphenyl)piperidin-2-one
rel-(5R,6S)-5-(4-acetyl-1,4-diazepane-1-carbonyl)-1-(2-methoxyethyl)-6-(4-methylphenyl)piperidin-2-one
Compound characteristics
| Compound ID: | SA17-0650 |
| Compound Name: | rel-(5R,6S)-5-(4-acetyl-1,4-diazepane-1-carbonyl)-1-(2-methoxyethyl)-6-(4-methylphenyl)piperidin-2-one |
| Molecular Weight: | 415.53 |
| Molecular Formula: | C23 H33 N3 O4 |
| Smiles: | CC(N1CCCN(CC1)C([C@@H]1CCC(N(CCOC)[C@@H]1c1ccc(C)cc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5147 |
| logD: | 1.5147 |
| logSw: | -2.6145 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.968 |
| InChI Key: | CFFDHURUENCKAJ-RBBKRZOGSA-N |