[rel-(3R,4R)-3-(dimethylamino)-4-(hydroxymethyl)piperidin-1-yl][3-(4-methylphenyl)-1H-pyrazol-5-yl]methanone
Chemical Structure Depiction of
[rel-(3R,4R)-3-(dimethylamino)-4-(hydroxymethyl)piperidin-1-yl][3-(4-methylphenyl)-1H-pyrazol-5-yl]methanone
[rel-(3R,4R)-3-(dimethylamino)-4-(hydroxymethyl)piperidin-1-yl][3-(4-methylphenyl)-1H-pyrazol-5-yl]methanone
Compound characteristics
| Compound ID: | S617-0398 |
| Compound Name: | [rel-(3R,4R)-3-(dimethylamino)-4-(hydroxymethyl)piperidin-1-yl][3-(4-methylphenyl)-1H-pyrazol-5-yl]methanone |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C19 H26 N4 O2 |
| Smiles: | Cc1ccc(cc1)c1cc(C(N2CC[C@H](CO)[C@@H](C2)N(C)C)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1269 |
| logD: | 0.8401 |
| logSw: | -2.7679 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.336 |
| InChI Key: | RVEDMWNXRFHUMR-QAPCUYQASA-N |