rel-(3R,4R)-4-(hydroxymethyl)-N-methyl-1-[4-(propan-2-yl)benzoyl]pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-4-(hydroxymethyl)-N-methyl-1-[4-(propan-2-yl)benzoyl]pyrrolidine-3-carboxamide
rel-(3R,4R)-4-(hydroxymethyl)-N-methyl-1-[4-(propan-2-yl)benzoyl]pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-4677 |
| Compound Name: | rel-(3R,4R)-4-(hydroxymethyl)-N-methyl-1-[4-(propan-2-yl)benzoyl]pyrrolidine-3-carboxamide |
| Molecular Weight: | 304.39 |
| Molecular Formula: | C17 H24 N2 O3 |
| Smiles: | CC(C)c1ccc(cc1)C(N1C[C@@H](CO)[C@@H](C1)C(NC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0647 |
| logD: | 1.0647 |
| logSw: | -2.0188 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.07 |
| InChI Key: | HDQYYWMHLZMDKM-LSDHHAIUSA-N |