N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-4-methoxy-2-methylbenzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-4-methoxy-2-methylbenzamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-4-methoxy-2-methylbenzamide
Compound characteristics
| Compound ID: | S823-1273 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-4-methoxy-2-methylbenzamide |
| Molecular Weight: | 355.44 |
| Molecular Formula: | C20 H25 N3 O3 |
| Smiles: | Cc1cc(ccc1C(N[C@@H]1CN(Cc2ccccn2)C[C@H]1CO)=O)OC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4709 |
| logD: | 0.749 |
| logSw: | -2.3617 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.743 |
| InChI Key: | VGLYGPIMURRLIH-BEFAXECRSA-N |