1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(4-ethoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(4-ethoxyphenyl)ethan-1-one
1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(4-ethoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S823-4341 |
| Compound Name: | 1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(4-ethoxyphenyl)ethan-1-one |
| Molecular Weight: | 306.4 |
| Molecular Formula: | C17 H26 N2 O3 |
| Smiles: | CCOc1ccc(CC(N2C[C@H]([C@@H](C2)CO)N(C)C)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0843 |
| logD: | -0.719 |
| logSw: | -1.6533 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.742 |
| InChI Key: | PYQLEJUJGASAEP-GOEBONIOSA-N |