rel-(3R,4R)-1-[(4-chloro-2-methylphenoxy)acetyl]-4-(hydroxymethyl)-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-[(4-chloro-2-methylphenoxy)acetyl]-4-(hydroxymethyl)-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-[(4-chloro-2-methylphenoxy)acetyl]-4-(hydroxymethyl)-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-4023 |
| Compound Name: | rel-(3R,4R)-1-[(4-chloro-2-methylphenoxy)acetyl]-4-(hydroxymethyl)-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 340.8 |
| Molecular Formula: | C16 H21 Cl N2 O4 |
| Smiles: | Cc1cc(ccc1OCC(N1C[C@@H](CO)[C@@H](C1)C(NC)=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0565 |
| logD: | 1.0565 |
| logSw: | -2.5191 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.128 |
| InChI Key: | MVFAUIJITOBYST-WCQYABFASA-N |