rel-(3R,4R)-1-[(4-chlorophenoxy)acetyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-[(4-chlorophenoxy)acetyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-[(4-chlorophenoxy)acetyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-2517 |
| Compound Name: | rel-(3R,4R)-1-[(4-chlorophenoxy)acetyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 340.8 |
| Molecular Formula: | C16 H21 Cl N2 O4 |
| Smiles: | CNC([C@@H]1CN(C[C@H]1COC)C(COc1ccc(cc1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7962 |
| logD: | 0.7962 |
| logSw: | -2.3385 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.35 |
| InChI Key: | NJQSDKWGKMPAJI-SMDDNHRTSA-N |