N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)acetamide
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Compound characteristics
| Compound ID: | S639-3433 |
| Compound Name: | N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)acetamide |
| Molecular Weight: | 357.47 |
| Molecular Formula: | C15 H27 N5 O3 S |
| Smiles: | Cc1cc(C)n(CC(N[C@@H]2CN(C[C@H]2CN(C)C)S(C)(=O)=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.1999 |
| logD: | -3.1821 |
| logSw: | -1.8306 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.964 |
| InChI Key: | CBSVMOXFLLRYQS-ZIAGYGMSSA-N |