rel-(3R,4R)-1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-2261 |
| Compound Name: | rel-(3R,4R)-1-[(2-chloro-3,4-dimethoxyphenyl)methyl]-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 356.85 |
| Molecular Formula: | C17 H25 Cl N2 O4 |
| Smiles: | CNC([C@@H]1CN(Cc2ccc(c(c2[Cl])OC)OC)C[C@H]1COC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5273 |
| logD: | -1.4601 |
| logSw: | -2.8611 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.811 |
| InChI Key: | DKYGWGVQDCGWAO-QWHCGFSZSA-N |