2-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-5-fluorobenzamide
Chemical Structure Depiction of
2-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-5-fluorobenzamide
2-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-5-fluorobenzamide
Compound characteristics
| Compound ID: | S639-0090 |
| Compound Name: | 2-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-5-fluorobenzamide |
| Molecular Weight: | 313.8 |
| Molecular Formula: | C15 H21 Cl F N3 O |
| Smiles: | CN(C)C[C@@H]1CN(C)C[C@H]1NC(c1cc(ccc1[Cl])F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8774 |
| logD: | -0.2688 |
| logSw: | -3.2279 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.364 |
| InChI Key: | PFEORFMJPJVKTK-HZMBPMFUSA-N |