2-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-5-fluorobenzamide
Chemical Structure Depiction of
2-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-5-fluorobenzamide
2-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-5-fluorobenzamide
Compound characteristics
| Compound ID: | S639-1292 |
| Compound Name: | 2-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}-5-fluorobenzamide |
| Molecular Weight: | 390.89 |
| Molecular Formula: | C20 H24 Cl F N4 O |
| Smiles: | CN(C)C[C@@H]1CN(Cc2ccccn2)C[C@H]1NC(c1cc(ccc1[Cl])F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3036 |
| logD: | 0.237 |
| logSw: | -3.526 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.971 |
| InChI Key: | OUGOADPZEARKCG-LIRRHRJNSA-N |