N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-3,5-difluorobenzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-3,5-difluorobenzamide
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-3,5-difluorobenzamide
Compound characteristics
| Compound ID: | S639-1268 |
| Compound Name: | N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-3,5-difluorobenzamide |
| Molecular Weight: | 374.43 |
| Molecular Formula: | C20 H24 F2 N4 O |
| Smiles: | CN(C)C[C@@H]1CN(Cc2ccccn2)C[C@H]1NC(c1cc(cc(c1)F)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7533 |
| logD: | -0.3133 |
| logSw: | -2.3253 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.971 |
| InChI Key: | UPWIQOZKMSIZEA-KXBFYZLASA-N |