rel-(5R,6S)-5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-6-(methoxymethyl)piperidin-2-one
Chemical Structure Depiction of
rel-(5R,6S)-5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-6-(methoxymethyl)piperidin-2-one
rel-(5R,6S)-5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-6-(methoxymethyl)piperidin-2-one
Compound characteristics
| Compound ID: | S760-0063 |
| Compound Name: | rel-(5R,6S)-5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-6-(methoxymethyl)piperidin-2-one |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C20 H29 N3 O3 |
| Smiles: | Cc1cccc(c1C)N1CCN(CC1)C([C@@H]1CCC(N[C@@H]1COC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0017 |
| logD: | 2.0016 |
| logSw: | -2.8911 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.18 |
| InChI Key: | QOZFBQKOTTZMNU-SJORKVTESA-N |