N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-2-yl)pyrrolidin-3-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-2-yl)pyrrolidin-3-yl]thiophene-2-sulfonamide
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-2-yl)pyrrolidin-3-yl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | S639-3837 |
| Compound Name: | N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-2-yl)pyrrolidin-3-yl]thiophene-2-sulfonamide |
| Molecular Weight: | 367.49 |
| Molecular Formula: | C15 H21 N5 O2 S2 |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NS(c1cccs1)(=O)=O)c1ncccn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3507 |
| logD: | -0.5276 |
| logSw: | -2.4403 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.087 |
| InChI Key: | PMOWDEGKXLWLSI-STQMWFEESA-N |