rel-(3R,4R)-1-[(3-chloro-4-methoxyphenyl)acetyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-[(3-chloro-4-methoxyphenyl)acetyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-[(3-chloro-4-methoxyphenyl)acetyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-2251 |
| Compound Name: | rel-(3R,4R)-1-[(3-chloro-4-methoxyphenyl)acetyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 354.83 |
| Molecular Formula: | C17 H23 Cl N2 O4 |
| Smiles: | CNC([C@@H]1CN(C[C@H]1COC)C(Cc1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0986 |
| logD: | 1.0986 |
| logSw: | -2.6508 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.482 |
| InChI Key: | BAOLKNLMQKNFTR-QWHCGFSZSA-N |