N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-3-methoxybenzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-3-methoxybenzamide
N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-3-methoxybenzamide
Compound characteristics
| Compound ID: | S823-1199 |
| Compound Name: | N-{rel-(3R,4S)-4-(hydroxymethyl)-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-3-methoxybenzamide |
| Molecular Weight: | 341.41 |
| Molecular Formula: | C19 H23 N3 O3 |
| Smiles: | COc1cccc(c1)C(N[C@@H]1CN(Cc2ccccn2)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.825 |
| logD: | 0.103 |
| logSw: | -1.9705 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.743 |
| InChI Key: | NDYSSZPNGZZGPL-QAPCUYQASA-N |