N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-2-methoxybenzamide
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | S639-1452 |
| Compound Name: | N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-2-methoxybenzamide |
| Molecular Weight: | 368.48 |
| Molecular Formula: | C21 H28 N4 O2 |
| Smiles: | CN(C)C[C@@H]1CN(Cc2ccncc2)C[C@H]1NC(c1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1263 |
| logD: | -0.9403 |
| logSw: | -1.882 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.486 |
| InChI Key: | IPFPYJVPUYXIMK-HKUYNNGSSA-N |