4-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-3-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-3-methylbenzene-1-sulfonamide
4-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-3-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | S639-0335 |
| Compound Name: | 4-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-methylpyrrolidin-3-yl}-3-methylbenzene-1-sulfonamide |
| Molecular Weight: | 345.89 |
| Molecular Formula: | C15 H24 Cl N3 O2 S |
| Smiles: | Cc1cc(ccc1[Cl])S(N[C@@H]1CN(C)C[C@H]1CN(C)C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1614 |
| logD: | 0.4235 |
| logSw: | -3.0768 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.922 |
| InChI Key: | SQBKXLNWSGWVFE-WFASDCNBSA-N |