N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[4-(propan-2-yl)benzoyl]pyrrolidin-3-yl}acetamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[4-(propan-2-yl)benzoyl]pyrrolidin-3-yl}acetamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[4-(propan-2-yl)benzoyl]pyrrolidin-3-yl}acetamide
Compound characteristics
| Compound ID: | S823-4633 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[4-(propan-2-yl)benzoyl]pyrrolidin-3-yl}acetamide |
| Molecular Weight: | 304.39 |
| Molecular Formula: | C17 H24 N2 O3 |
| Smiles: | CC(C)c1ccc(cc1)C(N1C[C@H]([C@@H](C1)CO)NC(C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0664 |
| logD: | 1.0664 |
| logSw: | -1.815 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.742 |
| InChI Key: | GSCFRHOPFOYIDJ-JKSUJKDBSA-N |