[rel-(3R,4R)-3-(dimethylamino)-4-(hydroxymethyl)piperidin-1-yl]{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}methanone
Chemical Structure Depiction of
[rel-(3R,4R)-3-(dimethylamino)-4-(hydroxymethyl)piperidin-1-yl]{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}methanone
[rel-(3R,4R)-3-(dimethylamino)-4-(hydroxymethyl)piperidin-1-yl]{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}methanone
Compound characteristics
| Compound ID: | S617-0390 |
| Compound Name: | [rel-(3R,4R)-3-(dimethylamino)-4-(hydroxymethyl)piperidin-1-yl]{5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-yl}methanone |
| Molecular Weight: | 360.46 |
| Molecular Formula: | C19 H28 N4 O3 |
| Smiles: | Cc1cc(C)n(Cc2ccc(C(N3CC[C@H](CO)[C@@H](C3)N(C)C)=O)o2)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4447 |
| logD: | -0.83 |
| logSw: | -1.5661 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.423 |
| InChI Key: | UUZSWTMVCRORDB-WBVHZDCISA-N |