(2-chloro-4-fluorophenyl)[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(2-chloro-4-fluorophenyl)[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]methanone
(2-chloro-4-fluorophenyl)[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | S823-3931 |
| Compound Name: | (2-chloro-4-fluorophenyl)[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 300.76 |
| Molecular Formula: | C14 H18 Cl F N2 O2 |
| Smiles: | CN(C)[C@@H]1CN(C[C@H]1CO)C(c1ccc(cc1[Cl])F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0156 |
| logD: | 0.0583 |
| logSw: | -2.7353 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.146 |
| InChI Key: | PVKANTVZIULJSD-TVQRCGJNSA-N |