N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-4-fluorobenzamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-4-fluorobenzamide
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | S639-1450 |
| Compound Name: | N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-4-fluorobenzamide |
| Molecular Weight: | 356.44 |
| Molecular Formula: | C20 H25 F N4 O |
| Smiles: | CN(C)C[C@@H]1CN(Cc2ccncc2)C[C@H]1NC(c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0221 |
| logD: | -1.0446 |
| logSw: | -1.6316 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.856 |
| InChI Key: | WTDOHONYIRPFOQ-HKUYNNGSSA-N |