1-[rel-(3R,4S)-4-(dimethylamino)-3-(hydroxymethyl)piperidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4S)-4-(dimethylamino)-3-(hydroxymethyl)piperidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
1-[rel-(3R,4S)-4-(dimethylamino)-3-(hydroxymethyl)piperidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S292-0016 |
| Compound Name: | 1-[rel-(3R,4S)-4-(dimethylamino)-3-(hydroxymethyl)piperidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 306.4 |
| Molecular Formula: | C17 H26 N2 O3 |
| Smiles: | CN(C)[C@@H]1CCN(C[C@@H]1CO)C(Cc1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9394 |
| logD: | -2.4661 |
| logSw: | -1.4082 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.863 |
| InChI Key: | KBPKERDQPUAIOI-GOEBONIOSA-N |