1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(2-fluorophenyl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(2-fluorophenyl)ethan-1-one
1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(2-fluorophenyl)ethan-1-one
Compound characteristics
Compound ID: | S823-4326 |
Compound Name: | 1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]-2-(2-fluorophenyl)ethan-1-one |
Molecular Weight: | 280.34 |
Molecular Formula: | C15 H21 F N2 O2 |
Smiles: | CN(C)[C@@H]1CN(C[C@H]1CO)C(Cc1ccccc1F)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 0.949 |
logD: | -0.8543 |
logSw: | -1.2201 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 35.618 |
InChI Key: | HOZRVXNCERGARZ-GXTWGEPZSA-N |