N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(2-methylphenyl)acetyl]pyrrolidin-3-yl}benzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(2-methylphenyl)acetyl]pyrrolidin-3-yl}benzamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(2-methylphenyl)acetyl]pyrrolidin-3-yl}benzamide
Compound characteristics
| Compound ID: | S823-7672 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(2-methylphenyl)acetyl]pyrrolidin-3-yl}benzamide |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C21 H24 N2 O3 |
| Smiles: | Cc1ccccc1CC(N1C[C@H]([C@@H](C1)CO)NC(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.319 |
| logD: | 2.319 |
| logSw: | -2.347 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.044 |
| InChI Key: | UGPQTFHGPMWXSQ-MOPGFXCFSA-N |