N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-1-phenylmethanesulfonamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-1-phenylmethanesulfonamide
N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-1-phenylmethanesulfonamide
Compound characteristics
| Compound ID: | S639-1621 |
| Compound Name: | N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-4-yl)methyl]pyrrolidin-3-yl}-1-phenylmethanesulfonamide |
| Molecular Weight: | 388.53 |
| Molecular Formula: | C20 H28 N4 O2 S |
| Smiles: | CN(C)C[C@@H]1CN(Cc2ccncc2)C[C@H]1NS(Cc1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8066 |
| logD: | -0.9145 |
| logSw: | -1.9802 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.041 |
| InChI Key: | PGDDKLAEVFQXSZ-PMACEKPBSA-N |