rel-(3R,4R)-1-(3,4-dimethylbenzoyl)-4-(methoxymethyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-(3,4-dimethylbenzoyl)-4-(methoxymethyl)pyrrolidine-3-carboxamide
rel-(3R,4R)-1-(3,4-dimethylbenzoyl)-4-(methoxymethyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-2935 |
| Compound Name: | rel-(3R,4R)-1-(3,4-dimethylbenzoyl)-4-(methoxymethyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 290.36 |
| Molecular Formula: | C16 H22 N2 O3 |
| Smiles: | Cc1ccc(cc1C)C(N1C[C@@H](COC)[C@@H](C1)C(N)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.095 |
| logD: | 1.095 |
| logSw: | -2.2775 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.602 |
| InChI Key: | QCELIRQBWHZZIU-UONOGXRCSA-N |